diff --git a/pixi.lock b/pixi.lock index 3e89a62..0237410 100644 --- a/pixi.lock +++ b/pixi.lock @@ -35,7 +35,7 @@ environments: - conda: https://conda.anaconda.org/conda-forge/noarch/tzdata-2025c-hc9c84f9_1.conda - conda: https://conda.anaconda.org/conda-forge/linux-64/zstd-1.5.7-hb78ec9c_6.conda - pypi: https://files.pythonhosted.org/packages/c5/0d/84a4380f930db0010168e0aa7b7a8fed9ba1835a8fbb1472bc6d0201d529/build-1.4.0-py3-none-any.whl - - pypi: https://files.pythonhosted.org/packages/e2/67/3ae32a1ddae8d6c0da5e9b91f0df69fb1748ff41342010245c077e083815/conservedwatersearch-0.5.0-py3-none-any.whl + - pypi: https://files.pythonhosted.org/packages/b4/d1/ebe68f13ea1444025bd1b45854f1a59d8f06af3498702f4e00ebd4a0e33e/conservedwatersearch-0.5.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/04/5f/9ff93450ba96b09c7c2b3f81c94de31c89f92292f1380261bd7195bea4ea/contourpy-1.3.3-cp314-cp314-manylinux_2_27_x86_64.manylinux_2_28_x86_64.whl - pypi: https://files.pythonhosted.org/packages/e7/05/c19819d5e3d95294a6f5947fb9b9629efb316b96de511b418c53d245aae6/cycler-0.12.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/b5/36/7fb70f04bf00bc646cd5bb45aa9eddb15e19437a28b8fb2b4a5249fac770/filelock-3.20.3-py3-none-any.whl @@ -70,7 +70,7 @@ environments: - conda: https://conda.anaconda.org/conda-forge/osx-64/libsqlite-3.51.2-hb99441e_0.conda - conda: https://conda.anaconda.org/conda-forge/osx-64/libzlib-1.3.1-hd23fc13_2.conda - conda: https://conda.anaconda.org/conda-forge/osx-64/ncurses-6.5-h0622a9a_3.conda - - conda: https://conda.anaconda.org/conda-forge/osx-64/openssl-3.6.1-hb6871ef_0.conda + - conda: https://conda.anaconda.org/conda-forge/osx-64/openssl-3.6.1-hb6871ef_1.conda - conda: https://conda.anaconda.org/conda-forge/noarch/pip-25.3-pyh145f28c_0.conda - conda: https://conda.anaconda.org/conda-forge/osx-64/python-3.14.2-hf88997e_101_cp314.conda - conda: https://conda.anaconda.org/conda-forge/noarch/python_abi-3.14-8_cp314.conda @@ -79,7 +79,7 @@ environments: - conda: https://conda.anaconda.org/conda-forge/noarch/tzdata-2025c-hc9c84f9_1.conda - conda: https://conda.anaconda.org/conda-forge/osx-64/zstd-1.5.7-h3eecb57_6.conda - pypi: https://files.pythonhosted.org/packages/c5/0d/84a4380f930db0010168e0aa7b7a8fed9ba1835a8fbb1472bc6d0201d529/build-1.4.0-py3-none-any.whl - - pypi: https://files.pythonhosted.org/packages/e2/67/3ae32a1ddae8d6c0da5e9b91f0df69fb1748ff41342010245c077e083815/conservedwatersearch-0.5.0-py3-none-any.whl + - pypi: https://files.pythonhosted.org/packages/b4/d1/ebe68f13ea1444025bd1b45854f1a59d8f06af3498702f4e00ebd4a0e33e/conservedwatersearch-0.5.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/72/8b/4546f3ab60f78c514ffb7d01a0bd743f90de36f0019d1be84d0a708a580a/contourpy-1.3.3-cp314-cp314-macosx_10_13_x86_64.whl - pypi: https://files.pythonhosted.org/packages/e7/05/c19819d5e3d95294a6f5947fb9b9629efb316b96de511b418c53d245aae6/cycler-0.12.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/b5/36/7fb70f04bf00bc646cd5bb45aa9eddb15e19437a28b8fb2b4a5249fac770/filelock-3.20.3-py3-none-any.whl @@ -115,7 +115,7 @@ environments: - conda: https://conda.anaconda.org/conda-forge/osx-arm64/libsqlite-3.51.2-h1ae2325_0.conda - conda: https://conda.anaconda.org/conda-forge/osx-arm64/libzlib-1.3.1-h8359307_2.conda - conda: https://conda.anaconda.org/conda-forge/osx-arm64/ncurses-6.5-h5e97a16_3.conda - - conda: https://conda.anaconda.org/conda-forge/osx-arm64/openssl-3.6.1-hd24854e_0.conda + - conda: https://conda.anaconda.org/conda-forge/osx-arm64/openssl-3.6.1-hd24854e_1.conda - conda: https://conda.anaconda.org/conda-forge/noarch/pip-25.3-pyh145f28c_0.conda - conda: https://conda.anaconda.org/conda-forge/osx-arm64/python-3.14.2-h40d2674_101_cp314.conda - conda: https://conda.anaconda.org/conda-forge/noarch/python_abi-3.14-8_cp314.conda @@ -124,7 +124,7 @@ environments: - conda: https://conda.anaconda.org/conda-forge/noarch/tzdata-2025c-hc9c84f9_1.conda - conda: https://conda.anaconda.org/conda-forge/osx-arm64/zstd-1.5.7-hbf9d68e_6.conda - pypi: https://files.pythonhosted.org/packages/c5/0d/84a4380f930db0010168e0aa7b7a8fed9ba1835a8fbb1472bc6d0201d529/build-1.4.0-py3-none-any.whl - - pypi: https://files.pythonhosted.org/packages/e2/67/3ae32a1ddae8d6c0da5e9b91f0df69fb1748ff41342010245c077e083815/conservedwatersearch-0.5.0-py3-none-any.whl + - pypi: https://files.pythonhosted.org/packages/b4/d1/ebe68f13ea1444025bd1b45854f1a59d8f06af3498702f4e00ebd4a0e33e/conservedwatersearch-0.5.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/fd/e1/3542a9cb596cadd76fcef413f19c79216e002623158befe6daa03dbfa88c/contourpy-1.3.3-cp314-cp314-macosx_11_0_arm64.whl - pypi: https://files.pythonhosted.org/packages/e7/05/c19819d5e3d95294a6f5947fb9b9629efb316b96de511b418c53d245aae6/cycler-0.12.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/b5/36/7fb70f04bf00bc646cd5bb45aa9eddb15e19437a28b8fb2b4a5249fac770/filelock-3.20.3-py3-none-any.whl @@ -158,7 +158,7 @@ environments: - conda: https://conda.anaconda.org/conda-forge/win-64/libmpdec-4.0.0-hfd05255_1.conda - conda: https://conda.anaconda.org/conda-forge/win-64/libsqlite-3.51.2-hf5d6505_0.conda - conda: https://conda.anaconda.org/conda-forge/win-64/libzlib-1.3.1-h2466b09_2.conda - - conda: https://conda.anaconda.org/conda-forge/win-64/openssl-3.6.1-hf411b9b_0.conda + - conda: https://conda.anaconda.org/conda-forge/win-64/openssl-3.6.1-hf411b9b_1.conda - conda: https://conda.anaconda.org/conda-forge/noarch/pip-25.3-pyh145f28c_0.conda - conda: https://conda.anaconda.org/conda-forge/win-64/python-3.14.2-h4b44e0e_101_cp314.conda - conda: https://conda.anaconda.org/conda-forge/noarch/python_abi-3.14-8_cp314.conda @@ -171,7 +171,7 @@ environments: - conda: https://conda.anaconda.org/conda-forge/win-64/zstd-1.5.7-h534d264_6.conda - pypi: https://files.pythonhosted.org/packages/c5/0d/84a4380f930db0010168e0aa7b7a8fed9ba1835a8fbb1472bc6d0201d529/build-1.4.0-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/d1/d6/3965ed04c63042e047cb6a3e6ed1a63a35087b6a609aa3a15ed8ac56c221/colorama-0.4.6-py2.py3-none-any.whl - - pypi: https://files.pythonhosted.org/packages/e2/67/3ae32a1ddae8d6c0da5e9b91f0df69fb1748ff41342010245c077e083815/conservedwatersearch-0.5.0-py3-none-any.whl + - pypi: https://files.pythonhosted.org/packages/b4/d1/ebe68f13ea1444025bd1b45854f1a59d8f06af3498702f4e00ebd4a0e33e/conservedwatersearch-0.5.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/7d/c2/57f54b03d0f22d4044b8afb9ca0e184f8b1afd57b4f735c2fa70883dc601/contourpy-1.3.3-cp314-cp314-win_amd64.whl - pypi: https://files.pythonhosted.org/packages/e7/05/c19819d5e3d95294a6f5947fb9b9629efb316b96de511b418c53d245aae6/cycler-0.12.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/b5/36/7fb70f04bf00bc646cd5bb45aa9eddb15e19437a28b8fb2b4a5249fac770/filelock-3.20.3-py3-none-any.whl @@ -214,46 +214,43 @@ environments: - conda: https://conda.anaconda.org/conda-forge/linux-64/libexpat-2.7.3-hecca717_0.conda - conda: https://conda.anaconda.org/conda-forge/linux-64/libffi-3.5.2-h3435931_0.conda - conda: https://conda.anaconda.org/conda-forge/linux-64/libgcc-15.2.0-he0feb66_16.conda - - conda: https://conda.anaconda.org/conda-forge/linux-64/libgcc-ng-15.2.0-h69a702a_16.conda - conda: https://conda.anaconda.org/conda-forge/linux-64/libgomp-15.2.0-he0feb66_16.conda - conda: https://conda.anaconda.org/conda-forge/linux-64/liblzma-5.8.2-hb03c661_0.conda - - conda: https://conda.anaconda.org/conda-forge/linux-64/libnsl-2.0.1-hb9d3cd8_1.conda + - conda: https://conda.anaconda.org/conda-forge/linux-64/libmpdec-4.0.0-hb03c661_1.conda - conda: https://conda.anaconda.org/conda-forge/linux-64/libsqlite-3.51.2-hf4e2dac_0.conda - conda: https://conda.anaconda.org/conda-forge/linux-64/libstdcxx-15.2.0-h934c35e_16.conda - conda: https://conda.anaconda.org/conda-forge/linux-64/libuuid-2.41.3-h5347b49_0.conda - - conda: https://conda.anaconda.org/conda-forge/linux-64/libxcrypt-4.4.36-hd590300_1.conda - conda: https://conda.anaconda.org/conda-forge/linux-64/libzlib-1.3.1-hb9d3cd8_2.conda - conda: https://conda.anaconda.org/conda-forge/linux-64/ncurses-6.5-h2d0b736_3.conda - conda: https://conda.anaconda.org/conda-forge/linux-64/openssl-3.6.1-h35e630c_1.conda - - conda: https://conda.anaconda.org/conda-forge/noarch/packaging-26.0-pyhcf101f3_0.conda - - conda: https://conda.anaconda.org/conda-forge/noarch/pip-25.3-pyh8b19718_0.conda - - conda: https://conda.anaconda.org/conda-forge/linux-64/python-3.12.12-hd63d673_2_cpython.conda + - conda: https://conda.anaconda.org/conda-forge/noarch/pip-25.3-pyh145f28c_0.conda + - conda: https://conda.anaconda.org/conda-forge/linux-64/python-3.14.2-h32b2ec7_101_cp314.conda + - conda: https://conda.anaconda.org/conda-forge/noarch/python_abi-3.14-8_cp314.conda - conda: https://conda.anaconda.org/conda-forge/linux-64/readline-8.3-h853b02a_0.conda - - conda: https://conda.anaconda.org/conda-forge/noarch/setuptools-80.10.1-pyh332efcf_0.conda - conda: https://conda.anaconda.org/conda-forge/linux-64/tk-8.6.13-noxft_h366c992_103.conda - conda: https://conda.anaconda.org/conda-forge/noarch/tzdata-2025c-hc9c84f9_1.conda - - conda: https://conda.anaconda.org/conda-forge/noarch/wheel-0.46.3-pyhd8ed1ab_0.conda - conda: https://conda.anaconda.org/conda-forge/linux-64/zstd-1.5.7-hb78ec9c_6.conda - - pypi: https://files.pythonhosted.org/packages/e2/67/3ae32a1ddae8d6c0da5e9b91f0df69fb1748ff41342010245c077e083815/conservedwatersearch-0.5.0-py3-none-any.whl - - pypi: https://files.pythonhosted.org/packages/cc/8f/ec6289987824b29529d0dfda0d74a07cec60e54b9c92f3c9da4c0ac732de/contourpy-1.3.3-cp312-cp312-manylinux_2_27_x86_64.manylinux_2_28_x86_64.whl + - pypi: https://files.pythonhosted.org/packages/b4/d1/ebe68f13ea1444025bd1b45854f1a59d8f06af3498702f4e00ebd4a0e33e/conservedwatersearch-0.5.1-py3-none-any.whl + - pypi: https://files.pythonhosted.org/packages/04/5f/9ff93450ba96b09c7c2b3f81c94de31c89f92292f1380261bd7195bea4ea/contourpy-1.3.3-cp314-cp314-manylinux_2_27_x86_64.manylinux_2_28_x86_64.whl - pypi: https://files.pythonhosted.org/packages/e7/05/c19819d5e3d95294a6f5947fb9b9629efb316b96de511b418c53d245aae6/cycler-0.12.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/b5/36/7fb70f04bf00bc646cd5bb45aa9eddb15e19437a28b8fb2b4a5249fac770/filelock-3.20.3-py3-none-any.whl - - pypi: https://files.pythonhosted.org/packages/b7/37/82dbef0f6342eb01f54bca073ac1498433d6ce71e50c3c3282b655733b31/fonttools-4.61.1-cp312-cp312-manylinux1_x86_64.manylinux2014_x86_64.manylinux_2_17_x86_64.manylinux_2_5_x86_64.whl + - pypi: https://files.pythonhosted.org/packages/89/18/58c64cafcf8eb677a99ef593121f719e6dcbdb7d1c594ae5a10d4997ca8a/fonttools-4.61.1-cp314-cp314-manylinux1_x86_64.manylinux2014_x86_64.manylinux_2_17_x86_64.manylinux_2_5_x86_64.whl - pypi: https://files.pythonhosted.org/packages/5e/ed/139ce29a650d9d4d35ce78b3fc4741da3d2a6d0f4db7b88d5f4ffcff8c77/griddataformats-1.1.0-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/7b/91/984aca2ec129e2757d1e4e3c81c3fcda9d0f85b74670a094cc443d9ee949/joblib-1.5.3-py3-none-any.whl - - pypi: https://files.pythonhosted.org/packages/70/90/6d240beb0f24b74371762873e9b7f499f1e02166a2d9c5801f4dbf8fa12e/kiwisolver-1.4.9-cp312-cp312-manylinux2014_x86_64.manylinux_2_17_x86_64.whl - - pypi: https://files.pythonhosted.org/packages/3e/f3/c5195b1ae57ef85339fd7285dfb603b22c8b4e79114bae5f4f0fcf688677/matplotlib-3.10.8-cp312-cp312-manylinux2014_x86_64.manylinux_2_17_x86_64.whl + - pypi: https://files.pythonhosted.org/packages/43/dc/51acc6791aa14e5cb6d8a2e28cefb0dc2886d8862795449d021334c0df20/kiwisolver-1.4.9-cp314-cp314-manylinux2014_x86_64.manylinux_2_17_x86_64.whl + - pypi: https://files.pythonhosted.org/packages/f5/26/4221a741eb97967bc1fd5e4c52b9aa5a91b2f4ec05b59f6def4d820f9df9/matplotlib-3.10.8-cp314-cp314-manylinux_2_27_x86_64.manylinux_2_28_x86_64.whl - pypi: https://files.pythonhosted.org/packages/4f/4b/5fe3a00833a9f9775b3c237624a6212798167278ffe10fe0de04f58612d0/mda_xdrlib-0.2.0-py3-none-any.whl - - pypi: https://files.pythonhosted.org/packages/4c/16/ad7fc0f8948075b9ab7f6957519492e861b2f16469f1ab0a916f7c3c4243/mdanalysis-2.10.0-cp312-cp312-manylinux_2_24_x86_64.manylinux_2_28_x86_64.whl + - pypi: https://files.pythonhosted.org/packages/52/b5/b7cbae73988bf7868009980c66a5d74725c99d2e2f11e0a566d0219ae53d/mdanalysis-2.10.0-cp314-cp314-manylinux_2_24_x86_64.manylinux_2_28_x86_64.whl - pypi: https://files.pythonhosted.org/packages/3c/f1/efea3da858043ed9c078f507ab744b6d00933c7bc8a75a24821937600178/mmtf_python-1.1.3-py2.py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/6f/cb/3f4ee8233f30c7926f1ed4885ff32b79ec7ce3210370f43e1cb2b385bed6/mrcfile-1.5.4-py2.py3-none-any.whl - - pypi: https://files.pythonhosted.org/packages/65/92/a5100f7185a800a5d29f8d14041f61475b9de465ffcc0f3b9fba606e4505/msgpack-1.1.2-cp312-cp312-manylinux2014_x86_64.manylinux_2_17_x86_64.manylinux_2_28_x86_64.whl - - pypi: https://files.pythonhosted.org/packages/d9/7d/9c8a781c88933725445a859cac5d01b5871588a15969ee6aeb618ba99eee/numpy-2.4.1-cp312-cp312-manylinux_2_27_x86_64.manylinux_2_28_x86_64.whl - - pypi: https://files.pythonhosted.org/packages/11/8f/48d0b77ab2200374c66d344459b8958c86693be99526450e7aee714e03e4/pillow-12.1.0-cp312-cp312-manylinux_2_27_x86_64.manylinux_2_28_x86_64.whl + - pypi: https://files.pythonhosted.org/packages/2f/40/dc34d1a8d5f1e51fc64640b62b191684da52ca469da9cd74e84936ffa4a6/msgpack-1.1.2-cp314-cp314-manylinux2014_x86_64.manylinux_2_17_x86_64.manylinux_2_28_x86_64.whl + - pypi: https://files.pythonhosted.org/packages/eb/c0/3ed5083d94e7ffd7c404e54619c088e11f2e1939a9544f5397f4adb1b8ba/numpy-2.4.1-cp314-cp314-manylinux_2_27_x86_64.manylinux_2_28_x86_64.whl + - pypi: https://files.pythonhosted.org/packages/b7/b9/c538f279a4e237a006a2c98387d081e9eb060d203d8ed34467cc0f0b9b53/packaging-26.0-py3-none-any.whl + - pypi: https://files.pythonhosted.org/packages/c4/5a/8ba375025701c09b309e8d5163c5a4ce0102fa86bbf8800eb0d7ac87bc51/pillow-12.1.0-cp314-cp314-manylinux_2_27_x86_64.manylinux_2_28_x86_64.whl - pypi: https://files.pythonhosted.org/packages/10/bd/c038d7cc38edc1aa5bf91ab8068b63d4308c66c4c8bb3cbba7dfbc049f9c/pyparsing-3.3.2-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/ec/57/56b9bcc3c9c6a792fcbaf139543cee77261f3651ca9da0c93f5c1221264b/python_dateutil-2.9.0.post0-py2.py3-none-any.whl - - pypi: https://files.pythonhosted.org/packages/97/74/b7a304feb2b49df9fafa9382d4d09061a96ee9a9449a7cbea7988dda0828/scikit_learn-1.8.0-cp312-cp312-manylinux_2_27_x86_64.manylinux_2_28_x86_64.whl - - pypi: https://files.pythonhosted.org/packages/d1/fe/66d73b76d378ba8cc2fe605920c0c75092e3a65ae746e1e767d9d020a75a/scipy-1.17.0-cp312-cp312-manylinux_2_27_x86_64.manylinux_2_28_x86_64.whl + - pypi: https://files.pythonhosted.org/packages/b8/cb/861b41341d6f1245e6ca80b1c1a8c4dfce43255b03df034429089ca2a2c5/scikit_learn-1.8.0-cp314-cp314-manylinux_2_27_x86_64.manylinux_2_28_x86_64.whl + - pypi: https://files.pythonhosted.org/packages/b8/7e/8c917cc573310e5dc91cbeead76f1b600d3fb17cf0969db02c9cf92e3cfa/scipy-1.17.0-cp314-cp314-manylinux_2_27_x86_64.manylinux_2_28_x86_64.whl - pypi: https://files.pythonhosted.org/packages/b7/ce/149a00dd41f10bc29e5921b496af8b574d8413afcd5e30dfa0ed46c2cc5e/six-1.17.0-py2.py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/32/d5/f9a850d79b0851d1d4ef6456097579a9005b31fea68726a4ae5f2d82ddd9/threadpoolctl-3.6.0-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/d0/30/dc54f88dd4a2b5dc8a0279bdd7270e735851848b762aeb1c1184ed1f6b14/tqdm-4.67.1-py3-none-any.whl @@ -263,38 +260,39 @@ environments: - conda: https://conda.anaconda.org/conda-forge/osx-64/libexpat-2.7.3-heffb93a_0.conda - conda: https://conda.anaconda.org/conda-forge/osx-64/libffi-3.5.2-hd1f9c09_0.conda - conda: https://conda.anaconda.org/conda-forge/osx-64/liblzma-5.8.2-h11316ed_0.conda + - conda: https://conda.anaconda.org/conda-forge/osx-64/libmpdec-4.0.0-hf3981d6_1.conda - conda: https://conda.anaconda.org/conda-forge/osx-64/libsqlite-3.51.2-hb99441e_0.conda - conda: https://conda.anaconda.org/conda-forge/osx-64/libzlib-1.3.1-hd23fc13_2.conda - conda: https://conda.anaconda.org/conda-forge/osx-64/ncurses-6.5-h0622a9a_3.conda - - conda: https://conda.anaconda.org/conda-forge/osx-64/openssl-3.6.1-hb6871ef_0.conda - - conda: https://conda.anaconda.org/conda-forge/noarch/packaging-26.0-pyhcf101f3_0.conda - - conda: https://conda.anaconda.org/conda-forge/noarch/pip-25.3-pyh8b19718_0.conda - - conda: https://conda.anaconda.org/conda-forge/osx-64/python-3.12.12-h74c2667_2_cpython.conda + - conda: https://conda.anaconda.org/conda-forge/osx-64/openssl-3.6.1-hb6871ef_1.conda + - conda: https://conda.anaconda.org/conda-forge/noarch/pip-25.3-pyh145f28c_0.conda + - conda: https://conda.anaconda.org/conda-forge/osx-64/python-3.14.2-hf88997e_101_cp314.conda + - conda: https://conda.anaconda.org/conda-forge/noarch/python_abi-3.14-8_cp314.conda - conda: https://conda.anaconda.org/conda-forge/osx-64/readline-8.3-h68b038d_0.conda - - conda: https://conda.anaconda.org/conda-forge/noarch/setuptools-80.10.1-pyh332efcf_0.conda - conda: https://conda.anaconda.org/conda-forge/osx-64/tk-8.6.13-h7142dee_3.conda - conda: https://conda.anaconda.org/conda-forge/noarch/tzdata-2025c-hc9c84f9_1.conda - - conda: https://conda.anaconda.org/conda-forge/noarch/wheel-0.46.3-pyhd8ed1ab_0.conda - - pypi: https://files.pythonhosted.org/packages/e2/67/3ae32a1ddae8d6c0da5e9b91f0df69fb1748ff41342010245c077e083815/conservedwatersearch-0.5.0-py3-none-any.whl - - pypi: https://files.pythonhosted.org/packages/be/45/adfee365d9ea3d853550b2e735f9d66366701c65db7855cd07621732ccfc/contourpy-1.3.3-cp312-cp312-macosx_10_13_x86_64.whl + - conda: https://conda.anaconda.org/conda-forge/osx-64/zstd-1.5.7-h3eecb57_6.conda + - pypi: https://files.pythonhosted.org/packages/b4/d1/ebe68f13ea1444025bd1b45854f1a59d8f06af3498702f4e00ebd4a0e33e/conservedwatersearch-0.5.1-py3-none-any.whl + - pypi: https://files.pythonhosted.org/packages/72/8b/4546f3ab60f78c514ffb7d01a0bd743f90de36f0019d1be84d0a708a580a/contourpy-1.3.3-cp314-cp314-macosx_10_13_x86_64.whl - pypi: https://files.pythonhosted.org/packages/e7/05/c19819d5e3d95294a6f5947fb9b9629efb316b96de511b418c53d245aae6/cycler-0.12.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/b5/36/7fb70f04bf00bc646cd5bb45aa9eddb15e19437a28b8fb2b4a5249fac770/filelock-3.20.3-py3-none-any.whl - - pypi: https://files.pythonhosted.org/packages/94/98/3c4cb97c64713a8cf499b3245c3bf9a2b8fd16a3e375feff2aed78f96259/fonttools-4.61.1-cp312-cp312-macosx_10_13_x86_64.whl + - pypi: https://files.pythonhosted.org/packages/71/09/d44e45d0a4f3a651f23a1e9d42de43bc643cce2971b19e784cc67d823676/fonttools-4.61.1-cp314-cp314-macosx_10_15_x86_64.whl - pypi: https://files.pythonhosted.org/packages/5e/ed/139ce29a650d9d4d35ce78b3fc4741da3d2a6d0f4db7b88d5f4ffcff8c77/griddataformats-1.1.0-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/7b/91/984aca2ec129e2757d1e4e3c81c3fcda9d0f85b74670a094cc443d9ee949/joblib-1.5.3-py3-none-any.whl - - pypi: https://files.pythonhosted.org/packages/51/ea/2ecf727927f103ffd1739271ca19c424d0e65ea473fbaeea1c014aea93f6/kiwisolver-1.4.9-cp312-cp312-macosx_10_13_x86_64.whl - - pypi: https://files.pythonhosted.org/packages/9e/67/f997cdcbb514012eb0d10cd2b4b332667997fb5ebe26b8d41d04962fa0e6/matplotlib-3.10.8-cp312-cp312-macosx_10_13_x86_64.whl + - pypi: https://files.pythonhosted.org/packages/b2/dd/2bfb1d4a4823d92e8cbb420fe024b8d2167f72079b3bb941207c42570bdf/kiwisolver-1.4.9-cp314-cp314-macosx_10_13_x86_64.whl + - pypi: https://files.pythonhosted.org/packages/3c/43/9c0ff7a2f11615e516c3b058e1e6e8f9614ddeca53faca06da267c48345d/matplotlib-3.10.8-cp314-cp314-macosx_10_13_x86_64.whl - pypi: https://files.pythonhosted.org/packages/4f/4b/5fe3a00833a9f9775b3c237624a6212798167278ffe10fe0de04f58612d0/mda_xdrlib-0.2.0-py3-none-any.whl - - pypi: https://files.pythonhosted.org/packages/57/8c/8d037a8010e92959631fa05811df43e4710b8e828bd18ea3da73189d5ce8/mdanalysis-2.10.0-cp312-cp312-macosx_10_13_x86_64.whl + - pypi: https://files.pythonhosted.org/packages/85/31/621980971edbed31c17f65209adc8da32a45aef0e3bb0a1f5ad2e150820e/mdanalysis-2.10.0-cp314-cp314-macosx_10_13_x86_64.whl - pypi: https://files.pythonhosted.org/packages/3c/f1/efea3da858043ed9c078f507ab744b6d00933c7bc8a75a24821937600178/mmtf_python-1.1.3-py2.py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/6f/cb/3f4ee8233f30c7926f1ed4885ff32b79ec7ce3210370f43e1cb2b385bed6/mrcfile-1.5.4-py2.py3-none-any.whl - - pypi: https://files.pythonhosted.org/packages/ad/bd/8b0d01c756203fbab65d265859749860682ccd2a59594609aeec3a144efa/msgpack-1.1.2-cp312-cp312-macosx_10_13_x86_64.whl - - pypi: https://files.pythonhosted.org/packages/78/7f/ec53e32bf10c813604edf07a3682616bd931d026fcde7b6d13195dfb684a/numpy-2.4.1-cp312-cp312-macosx_10_13_x86_64.whl - - pypi: https://files.pythonhosted.org/packages/20/31/dc53fe21a2f2996e1b7d92bf671cdb157079385183ef7c1ae08b485db510/pillow-12.1.0-cp312-cp312-macosx_10_13_x86_64.whl + - pypi: https://files.pythonhosted.org/packages/22/71/201105712d0a2ff07b7873ed3c220292fb2ea5120603c00c4b634bcdafb3/msgpack-1.1.2-cp314-cp314-macosx_10_13_x86_64.whl + - pypi: https://files.pythonhosted.org/packages/1b/a7/ef08d25698e0e4b4efbad8d55251d20fe2a15f6d9aa7c9b30cd03c165e6f/numpy-2.4.1-cp314-cp314-macosx_10_15_x86_64.whl + - pypi: https://files.pythonhosted.org/packages/b7/b9/c538f279a4e237a006a2c98387d081e9eb060d203d8ed34467cc0f0b9b53/packaging-26.0-py3-none-any.whl + - pypi: https://files.pythonhosted.org/packages/fc/36/2b8138e51cb42e4cc39c3297713455548be855a50558c3ac2beebdc251dd/pillow-12.1.0-cp314-cp314-macosx_10_15_x86_64.whl - pypi: https://files.pythonhosted.org/packages/10/bd/c038d7cc38edc1aa5bf91ab8068b63d4308c66c4c8bb3cbba7dfbc049f9c/pyparsing-3.3.2-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/ec/57/56b9bcc3c9c6a792fcbaf139543cee77261f3651ca9da0c93f5c1221264b/python_dateutil-2.9.0.post0-py2.py3-none-any.whl - - pypi: https://files.pythonhosted.org/packages/90/74/e6a7cc4b820e95cc38cf36cd74d5aa2b42e8ffc2d21fe5a9a9c45c1c7630/scikit_learn-1.8.0-cp312-cp312-macosx_10_13_x86_64.whl - - pypi: https://files.pythonhosted.org/packages/0b/11/7241a63e73ba5a516f1930ac8d5b44cbbfabd35ac73a2d08ca206df007c4/scipy-1.17.0-cp312-cp312-macosx_10_14_x86_64.whl + - pypi: https://files.pythonhosted.org/packages/24/05/1af2c186174cc92dcab2233f327336058c077d38f6fe2aceb08e6ab4d509/scikit_learn-1.8.0-cp314-cp314-macosx_10_15_x86_64.whl + - pypi: https://files.pythonhosted.org/packages/1a/2d/51006cd369b8e7879e1c630999a19d1fbf6f8b5ed3e33374f29dc87e53b3/scipy-1.17.0-cp314-cp314-macosx_10_14_x86_64.whl - pypi: https://files.pythonhosted.org/packages/b7/ce/149a00dd41f10bc29e5921b496af8b574d8413afcd5e30dfa0ed46c2cc5e/six-1.17.0-py2.py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/32/d5/f9a850d79b0851d1d4ef6456097579a9005b31fea68726a4ae5f2d82ddd9/threadpoolctl-3.6.0-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/d0/30/dc54f88dd4a2b5dc8a0279bdd7270e735851848b762aeb1c1184ed1f6b14/tqdm-4.67.1-py3-none-any.whl @@ -305,38 +303,39 @@ environments: - conda: https://conda.anaconda.org/conda-forge/osx-arm64/libexpat-2.7.3-haf25636_0.conda - conda: https://conda.anaconda.org/conda-forge/osx-arm64/libffi-3.5.2-hcf2aa1b_0.conda - conda: https://conda.anaconda.org/conda-forge/osx-arm64/liblzma-5.8.2-h8088a28_0.conda + - conda: https://conda.anaconda.org/conda-forge/osx-arm64/libmpdec-4.0.0-h84a0fba_1.conda - conda: https://conda.anaconda.org/conda-forge/osx-arm64/libsqlite-3.51.2-h1ae2325_0.conda - conda: https://conda.anaconda.org/conda-forge/osx-arm64/libzlib-1.3.1-h8359307_2.conda - conda: https://conda.anaconda.org/conda-forge/osx-arm64/ncurses-6.5-h5e97a16_3.conda - - conda: https://conda.anaconda.org/conda-forge/osx-arm64/openssl-3.6.1-hd24854e_0.conda - - conda: https://conda.anaconda.org/conda-forge/noarch/packaging-26.0-pyhcf101f3_0.conda - - conda: https://conda.anaconda.org/conda-forge/noarch/pip-25.3-pyh8b19718_0.conda - - conda: https://conda.anaconda.org/conda-forge/osx-arm64/python-3.12.12-h18782d2_2_cpython.conda + - conda: https://conda.anaconda.org/conda-forge/osx-arm64/openssl-3.6.1-hd24854e_1.conda + - conda: https://conda.anaconda.org/conda-forge/noarch/pip-25.3-pyh145f28c_0.conda + - conda: https://conda.anaconda.org/conda-forge/osx-arm64/python-3.14.2-h40d2674_101_cp314.conda + - conda: https://conda.anaconda.org/conda-forge/noarch/python_abi-3.14-8_cp314.conda - conda: https://conda.anaconda.org/conda-forge/osx-arm64/readline-8.3-h46df422_0.conda - - conda: https://conda.anaconda.org/conda-forge/noarch/setuptools-80.10.1-pyh332efcf_0.conda - conda: https://conda.anaconda.org/conda-forge/osx-arm64/tk-8.6.13-h010d191_3.conda - conda: https://conda.anaconda.org/conda-forge/noarch/tzdata-2025c-hc9c84f9_1.conda - - conda: https://conda.anaconda.org/conda-forge/noarch/wheel-0.46.3-pyhd8ed1ab_0.conda - - pypi: https://files.pythonhosted.org/packages/e2/67/3ae32a1ddae8d6c0da5e9b91f0df69fb1748ff41342010245c077e083815/conservedwatersearch-0.5.0-py3-none-any.whl - - pypi: https://files.pythonhosted.org/packages/53/3e/405b59cfa13021a56bba395a6b3aca8cec012b45bf177b0eaf7a202cde2c/contourpy-1.3.3-cp312-cp312-macosx_11_0_arm64.whl + - conda: https://conda.anaconda.org/conda-forge/osx-arm64/zstd-1.5.7-hbf9d68e_6.conda + - pypi: https://files.pythonhosted.org/packages/b4/d1/ebe68f13ea1444025bd1b45854f1a59d8f06af3498702f4e00ebd4a0e33e/conservedwatersearch-0.5.1-py3-none-any.whl + - pypi: https://files.pythonhosted.org/packages/fd/e1/3542a9cb596cadd76fcef413f19c79216e002623158befe6daa03dbfa88c/contourpy-1.3.3-cp314-cp314-macosx_11_0_arm64.whl - pypi: https://files.pythonhosted.org/packages/e7/05/c19819d5e3d95294a6f5947fb9b9629efb316b96de511b418c53d245aae6/cycler-0.12.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/b5/36/7fb70f04bf00bc646cd5bb45aa9eddb15e19437a28b8fb2b4a5249fac770/filelock-3.20.3-py3-none-any.whl - - pypi: https://files.pythonhosted.org/packages/6f/16/7decaa24a1bd3a70c607b2e29f0adc6159f36a7e40eaba59846414765fd4/fonttools-4.61.1-cp312-cp312-macosx_10_13_universal2.whl + - pypi: https://files.pythonhosted.org/packages/32/8f/4e7bf82c0cbb738d3c2206c920ca34ca74ef9dabde779030145d28665104/fonttools-4.61.1-cp314-cp314-macosx_10_15_universal2.whl - pypi: https://files.pythonhosted.org/packages/5e/ed/139ce29a650d9d4d35ce78b3fc4741da3d2a6d0f4db7b88d5f4ffcff8c77/griddataformats-1.1.0-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/7b/91/984aca2ec129e2757d1e4e3c81c3fcda9d0f85b74670a094cc443d9ee949/joblib-1.5.3-py3-none-any.whl - - pypi: https://files.pythonhosted.org/packages/5b/5a/51f5464373ce2aeb5194508298a508b6f21d3867f499556263c64c621914/kiwisolver-1.4.9-cp312-cp312-macosx_11_0_arm64.whl - - pypi: https://files.pythonhosted.org/packages/7e/65/07d5f5c7f7c994f12c768708bd2e17a4f01a2b0f44a1c9eccad872433e2e/matplotlib-3.10.8-cp312-cp312-macosx_11_0_arm64.whl + - pypi: https://files.pythonhosted.org/packages/f7/69/00aafdb4e4509c2ca6064646cba9cd4b37933898f426756adb2cb92ebbed/kiwisolver-1.4.9-cp314-cp314-macosx_11_0_arm64.whl + - pypi: https://files.pythonhosted.org/packages/6f/ca/e8ae28649fcdf039fda5ef554b40a95f50592a3c47e6f7270c9561c12b07/matplotlib-3.10.8-cp314-cp314-macosx_11_0_arm64.whl - pypi: https://files.pythonhosted.org/packages/4f/4b/5fe3a00833a9f9775b3c237624a6212798167278ffe10fe0de04f58612d0/mda_xdrlib-0.2.0-py3-none-any.whl - - pypi: https://files.pythonhosted.org/packages/08/e8/baae856d6764901cd13fe928cd4086ed755ae22f66928301a9327a4a2a3e/mdanalysis-2.10.0-cp312-cp312-macosx_11_0_arm64.whl + - pypi: https://files.pythonhosted.org/packages/5f/35/825d14ce918e3445e2f4da9dbc1488fcc77970031ed3e3fb5684fbf9753b/mdanalysis-2.10.0-cp314-cp314-macosx_11_0_arm64.whl - pypi: https://files.pythonhosted.org/packages/3c/f1/efea3da858043ed9c078f507ab744b6d00933c7bc8a75a24821937600178/mmtf_python-1.1.3-py2.py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/6f/cb/3f4ee8233f30c7926f1ed4885ff32b79ec7ce3210370f43e1cb2b385bed6/mrcfile-1.5.4-py2.py3-none-any.whl - - pypi: https://files.pythonhosted.org/packages/34/68/ba4f155f793a74c1483d4bdef136e1023f7bcba557f0db4ef3db3c665cf1/msgpack-1.1.2-cp312-cp312-macosx_11_0_arm64.whl - - pypi: https://files.pythonhosted.org/packages/b8/e0/1f9585d7dae8f14864e948fd7fa86c6cb72dee2676ca2748e63b1c5acfe0/numpy-2.4.1-cp312-cp312-macosx_11_0_arm64.whl - - pypi: https://files.pythonhosted.org/packages/ab/c1/10e45ac9cc79419cedf5121b42dcca5a50ad2b601fa080f58c22fb27626e/pillow-12.1.0-cp312-cp312-macosx_11_0_arm64.whl + - pypi: https://files.pythonhosted.org/packages/1b/9f/38ff9e57a2eade7bf9dfee5eae17f39fc0e998658050279cbb14d97d36d9/msgpack-1.1.2-cp314-cp314-macosx_11_0_arm64.whl + - pypi: https://files.pythonhosted.org/packages/8f/39/e378b3e3ca13477e5ac70293ec027c438d1927f18637e396fe90b1addd72/numpy-2.4.1-cp314-cp314-macosx_11_0_arm64.whl + - pypi: https://files.pythonhosted.org/packages/b7/b9/c538f279a4e237a006a2c98387d081e9eb060d203d8ed34467cc0f0b9b53/packaging-26.0-py3-none-any.whl + - pypi: https://files.pythonhosted.org/packages/53/4b/649056e4d22e1caa90816bf99cef0884aed607ed38075bd75f091a607a38/pillow-12.1.0-cp314-cp314-macosx_11_0_arm64.whl - pypi: https://files.pythonhosted.org/packages/10/bd/c038d7cc38edc1aa5bf91ab8068b63d4308c66c4c8bb3cbba7dfbc049f9c/pyparsing-3.3.2-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/ec/57/56b9bcc3c9c6a792fcbaf139543cee77261f3651ca9da0c93f5c1221264b/python_dateutil-2.9.0.post0-py2.py3-none-any.whl - - pypi: https://files.pythonhosted.org/packages/49/d8/9be608c6024d021041c7f0b3928d4749a706f4e2c3832bbede4fb4f58c95/scikit_learn-1.8.0-cp312-cp312-macosx_12_0_arm64.whl - - pypi: https://files.pythonhosted.org/packages/ed/1d/5057f812d4f6adc91a20a2d6f2ebcdb517fdbc87ae3acc5633c9b97c8ba5/scipy-1.17.0-cp312-cp312-macosx_12_0_arm64.whl + - pypi: https://files.pythonhosted.org/packages/a8/25/01c0af38fe969473fb292bba9dc2b8f9b451f3112ff242c647fee3d0dfe7/scikit_learn-1.8.0-cp314-cp314-macosx_12_0_arm64.whl + - pypi: https://files.pythonhosted.org/packages/d6/2e/2349458c3ce445f53a6c93d4386b1c4c5c0c540917304c01222ff95ff317/scipy-1.17.0-cp314-cp314-macosx_12_0_arm64.whl - pypi: https://files.pythonhosted.org/packages/b7/ce/149a00dd41f10bc29e5921b496af8b574d8413afcd5e30dfa0ed46c2cc5e/six-1.17.0-py2.py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/32/d5/f9a850d79b0851d1d4ef6456097579a9005b31fea68726a4ae5f2d82ddd9/threadpoolctl-3.6.0-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/d0/30/dc54f88dd4a2b5dc8a0279bdd7270e735851848b762aeb1c1184ed1f6b14/tqdm-4.67.1-py3-none-any.whl @@ -346,41 +345,42 @@ environments: - conda: https://conda.anaconda.org/conda-forge/win-64/libexpat-2.7.3-hac47afa_0.conda - conda: https://conda.anaconda.org/conda-forge/win-64/libffi-3.5.2-h3d046cb_0.conda - conda: https://conda.anaconda.org/conda-forge/win-64/liblzma-5.8.2-hfd05255_0.conda + - conda: https://conda.anaconda.org/conda-forge/win-64/libmpdec-4.0.0-hfd05255_1.conda - conda: https://conda.anaconda.org/conda-forge/win-64/libsqlite-3.51.2-hf5d6505_0.conda - conda: https://conda.anaconda.org/conda-forge/win-64/libzlib-1.3.1-h2466b09_2.conda - - conda: https://conda.anaconda.org/conda-forge/win-64/openssl-3.6.1-hf411b9b_0.conda - - conda: https://conda.anaconda.org/conda-forge/noarch/packaging-26.0-pyhcf101f3_0.conda - - conda: https://conda.anaconda.org/conda-forge/noarch/pip-25.3-pyh8b19718_0.conda - - conda: https://conda.anaconda.org/conda-forge/win-64/python-3.12.12-h0159041_2_cpython.conda - - conda: https://conda.anaconda.org/conda-forge/noarch/setuptools-80.10.1-pyh332efcf_0.conda + - conda: https://conda.anaconda.org/conda-forge/win-64/openssl-3.6.1-hf411b9b_1.conda + - conda: https://conda.anaconda.org/conda-forge/noarch/pip-25.3-pyh145f28c_0.conda + - conda: https://conda.anaconda.org/conda-forge/win-64/python-3.14.2-h4b44e0e_101_cp314.conda + - conda: https://conda.anaconda.org/conda-forge/noarch/python_abi-3.14-8_cp314.conda - conda: https://conda.anaconda.org/conda-forge/win-64/tk-8.6.13-h6ed50ae_3.conda - conda: https://conda.anaconda.org/conda-forge/noarch/tzdata-2025c-hc9c84f9_1.conda - conda: https://conda.anaconda.org/conda-forge/win-64/ucrt-10.0.26100.0-h57928b3_0.conda - conda: https://conda.anaconda.org/conda-forge/win-64/vc-14.3-h41ae7f8_34.conda - conda: https://conda.anaconda.org/conda-forge/win-64/vc14_runtime-14.44.35208-h818238b_34.conda - conda: https://conda.anaconda.org/conda-forge/win-64/vcomp14-14.44.35208-h818238b_34.conda - - conda: https://conda.anaconda.org/conda-forge/noarch/wheel-0.46.3-pyhd8ed1ab_0.conda + - conda: https://conda.anaconda.org/conda-forge/win-64/zstd-1.5.7-h534d264_6.conda - pypi: https://files.pythonhosted.org/packages/d1/d6/3965ed04c63042e047cb6a3e6ed1a63a35087b6a609aa3a15ed8ac56c221/colorama-0.4.6-py2.py3-none-any.whl - - pypi: https://files.pythonhosted.org/packages/e2/67/3ae32a1ddae8d6c0da5e9b91f0df69fb1748ff41342010245c077e083815/conservedwatersearch-0.5.0-py3-none-any.whl - - pypi: https://files.pythonhosted.org/packages/19/e8/6026ed58a64563186a9ee3f29f41261fd1828f527dd93d33b60feca63352/contourpy-1.3.3-cp312-cp312-win_amd64.whl + - pypi: https://files.pythonhosted.org/packages/b4/d1/ebe68f13ea1444025bd1b45854f1a59d8f06af3498702f4e00ebd4a0e33e/conservedwatersearch-0.5.1-py3-none-any.whl + - pypi: https://files.pythonhosted.org/packages/7d/c2/57f54b03d0f22d4044b8afb9ca0e184f8b1afd57b4f735c2fa70883dc601/contourpy-1.3.3-cp314-cp314-win_amd64.whl - pypi: https://files.pythonhosted.org/packages/e7/05/c19819d5e3d95294a6f5947fb9b9629efb316b96de511b418c53d245aae6/cycler-0.12.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/b5/36/7fb70f04bf00bc646cd5bb45aa9eddb15e19437a28b8fb2b4a5249fac770/filelock-3.20.3-py3-none-any.whl - - pypi: https://files.pythonhosted.org/packages/80/3b/a3e81b71aed5a688e89dfe0e2694b26b78c7d7f39a5ffd8a7d75f54a12a8/fonttools-4.61.1-cp312-cp312-win_amd64.whl + - pypi: https://files.pythonhosted.org/packages/52/7b/91e7b01e37cc8eb0e1f770d08305b3655e4f002fc160fb82b3390eabacf5/fonttools-4.61.1-cp314-cp314-win_amd64.whl - pypi: https://files.pythonhosted.org/packages/5e/ed/139ce29a650d9d4d35ce78b3fc4741da3d2a6d0f4db7b88d5f4ffcff8c77/griddataformats-1.1.0-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/7b/91/984aca2ec129e2757d1e4e3c81c3fcda9d0f85b74670a094cc443d9ee949/joblib-1.5.3-py3-none-any.whl - - pypi: https://files.pythonhosted.org/packages/a0/41/85d82b0291db7504da3c2defe35c9a8a5c9803a730f297bd823d11d5fb77/kiwisolver-1.4.9-cp312-cp312-win_amd64.whl - - pypi: https://files.pythonhosted.org/packages/30/4e/c10f171b6e2f44d9e3a2b96efa38b1677439d79c99357600a62cc1e9594e/matplotlib-3.10.8-cp312-cp312-win_amd64.whl + - pypi: https://files.pythonhosted.org/packages/28/e0/a9a90416fce5c0be25742729c2ea52105d62eda6c4be4d803c2a7be1fa50/kiwisolver-1.4.9-cp314-cp314-win_amd64.whl + - pypi: https://files.pythonhosted.org/packages/93/a5/de89ac80f10b8dc615807ee1133cd99ac74082581196d4d9590bea10690d/matplotlib-3.10.8-cp314-cp314-win_amd64.whl - pypi: https://files.pythonhosted.org/packages/4f/4b/5fe3a00833a9f9775b3c237624a6212798167278ffe10fe0de04f58612d0/mda_xdrlib-0.2.0-py3-none-any.whl - - pypi: https://files.pythonhosted.org/packages/61/1e/9952ca31d73d21a01f3499228274ae637ad1ff2f678a935b39711fdc9898/mdanalysis-2.10.0-cp312-cp312-win_amd64.whl + - pypi: https://files.pythonhosted.org/packages/1d/64/b14c5b438b6334a0d331ff88081c4dd0ca12f618e725610d3f3ebf6b8aed/mdanalysis-2.10.0-cp314-cp314-win_amd64.whl - pypi: https://files.pythonhosted.org/packages/3c/f1/efea3da858043ed9c078f507ab744b6d00933c7bc8a75a24821937600178/mmtf_python-1.1.3-py2.py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/6f/cb/3f4ee8233f30c7926f1ed4885ff32b79ec7ce3210370f43e1cb2b385bed6/mrcfile-1.5.4-py2.py3-none-any.whl - - pypi: https://files.pythonhosted.org/packages/8c/ec/d431eb7941fb55a31dd6ca3404d41fbb52d99172df2e7707754488390910/msgpack-1.1.2-cp312-cp312-win_amd64.whl - - pypi: https://files.pythonhosted.org/packages/51/cf/52a703dbeb0c65807540d29699fef5fda073434ff61846a564d5c296420f/numpy-2.4.1-cp312-cp312-win_amd64.whl - - pypi: https://files.pythonhosted.org/packages/a7/87/90b358775a3f02765d87655237229ba64a997b87efa8ccaca7dd3e36e7a7/pillow-12.1.0-cp312-cp312-win_amd64.whl + - pypi: https://files.pythonhosted.org/packages/6e/f1/abd09c2ae91228c5f3998dbd7f41353def9eac64253de3c8105efa2082f7/msgpack-1.1.2-cp314-cp314-win_amd64.whl + - pypi: https://files.pythonhosted.org/packages/7e/bb/c6513edcce5a831810e2dddc0d3452ce84d208af92405a0c2e58fd8e7881/numpy-2.4.1-cp314-cp314-win_amd64.whl + - pypi: https://files.pythonhosted.org/packages/b7/b9/c538f279a4e237a006a2c98387d081e9eb060d203d8ed34467cc0f0b9b53/packaging-26.0-py3-none-any.whl + - pypi: https://files.pythonhosted.org/packages/1c/af/f23697f587ac5f9095d67e31b81c95c0249cd461a9798a061ed6709b09b5/pillow-12.1.0-cp314-cp314-win_amd64.whl - pypi: https://files.pythonhosted.org/packages/10/bd/c038d7cc38edc1aa5bf91ab8068b63d4308c66c4c8bb3cbba7dfbc049f9c/pyparsing-3.3.2-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/ec/57/56b9bcc3c9c6a792fcbaf139543cee77261f3651ca9da0c93f5c1221264b/python_dateutil-2.9.0.post0-py2.py3-none-any.whl - - pypi: https://files.pythonhosted.org/packages/9f/c4/0ab22726a04ede56f689476b760f98f8f46607caecff993017ac1b64aa5d/scikit_learn-1.8.0-cp312-cp312-win_amd64.whl - - pypi: https://files.pythonhosted.org/packages/92/ce/672ed546f96d5d41ae78c4b9b02006cedd0b3d6f2bf5bb76ea455c320c28/scipy-1.17.0-cp312-cp312-win_amd64.whl + - pypi: https://files.pythonhosted.org/packages/76/18/a8def8f91b18cd1ba6e05dbe02540168cb24d47e8dcf69e8d00b7da42a08/scikit_learn-1.8.0-cp314-cp314-win_amd64.whl + - pypi: https://files.pythonhosted.org/packages/9f/ec/42a6657f8d2d087e750e9a5dde0b481fd135657f09eaf1cf5688bb23c338/scipy-1.17.0-cp314-cp314-win_amd64.whl - pypi: https://files.pythonhosted.org/packages/b7/ce/149a00dd41f10bc29e5921b496af8b574d8413afcd5e30dfa0ed46c2cc5e/six-1.17.0-py2.py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/32/d5/f9a850d79b0851d1d4ef6456097579a9005b31fea68726a4ae5f2d82ddd9/threadpoolctl-3.6.0-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/d0/30/dc54f88dd4a2b5dc8a0279bdd7270e735851848b762aeb1c1184ed1f6b14/tqdm-4.67.1-py3-none-any.whl @@ -418,7 +418,7 @@ environments: - conda: https://conda.anaconda.org/conda-forge/linux-64/tk-8.6.13-noxft_h366c992_103.conda - conda: https://conda.anaconda.org/conda-forge/noarch/tzdata-2025c-hc9c84f9_1.conda - conda: https://conda.anaconda.org/conda-forge/linux-64/zstd-1.5.7-hb78ec9c_6.conda - - pypi: https://files.pythonhosted.org/packages/e2/67/3ae32a1ddae8d6c0da5e9b91f0df69fb1748ff41342010245c077e083815/conservedwatersearch-0.5.0-py3-none-any.whl + - pypi: https://files.pythonhosted.org/packages/b4/d1/ebe68f13ea1444025bd1b45854f1a59d8f06af3498702f4e00ebd4a0e33e/conservedwatersearch-0.5.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/04/5f/9ff93450ba96b09c7c2b3f81c94de31c89f92292f1380261bd7195bea4ea/contourpy-1.3.3-cp314-cp314-manylinux_2_27_x86_64.manylinux_2_28_x86_64.whl - pypi: https://files.pythonhosted.org/packages/e7/05/c19819d5e3d95294a6f5947fb9b9629efb316b96de511b418c53d245aae6/cycler-0.12.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/b5/36/7fb70f04bf00bc646cd5bb45aa9eddb15e19437a28b8fb2b4a5249fac770/filelock-3.20.3-py3-none-any.whl @@ -454,7 +454,7 @@ environments: - conda: https://conda.anaconda.org/conda-forge/osx-64/libsqlite-3.51.2-hb99441e_0.conda - conda: https://conda.anaconda.org/conda-forge/osx-64/libzlib-1.3.1-hd23fc13_2.conda - conda: https://conda.anaconda.org/conda-forge/osx-64/ncurses-6.5-h0622a9a_3.conda - - conda: https://conda.anaconda.org/conda-forge/osx-64/openssl-3.6.1-hb6871ef_0.conda + - conda: https://conda.anaconda.org/conda-forge/osx-64/openssl-3.6.1-hb6871ef_1.conda - conda: https://conda.anaconda.org/conda-forge/noarch/pip-25.3-pyh145f28c_0.conda - conda: https://conda.anaconda.org/conda-forge/osx-64/python-3.14.2-hf88997e_101_cp314.conda - conda: https://conda.anaconda.org/conda-forge/noarch/python_abi-3.14-8_cp314.conda @@ -462,7 +462,7 @@ environments: - conda: https://conda.anaconda.org/conda-forge/osx-64/tk-8.6.13-h7142dee_3.conda - conda: https://conda.anaconda.org/conda-forge/noarch/tzdata-2025c-hc9c84f9_1.conda - conda: https://conda.anaconda.org/conda-forge/osx-64/zstd-1.5.7-h3eecb57_6.conda - - pypi: https://files.pythonhosted.org/packages/e2/67/3ae32a1ddae8d6c0da5e9b91f0df69fb1748ff41342010245c077e083815/conservedwatersearch-0.5.0-py3-none-any.whl + - pypi: https://files.pythonhosted.org/packages/b4/d1/ebe68f13ea1444025bd1b45854f1a59d8f06af3498702f4e00ebd4a0e33e/conservedwatersearch-0.5.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/72/8b/4546f3ab60f78c514ffb7d01a0bd743f90de36f0019d1be84d0a708a580a/contourpy-1.3.3-cp314-cp314-macosx_10_13_x86_64.whl - pypi: https://files.pythonhosted.org/packages/e7/05/c19819d5e3d95294a6f5947fb9b9629efb316b96de511b418c53d245aae6/cycler-0.12.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/b5/36/7fb70f04bf00bc646cd5bb45aa9eddb15e19437a28b8fb2b4a5249fac770/filelock-3.20.3-py3-none-any.whl @@ -499,7 +499,7 @@ environments: - conda: https://conda.anaconda.org/conda-forge/osx-arm64/libsqlite-3.51.2-h1ae2325_0.conda - conda: https://conda.anaconda.org/conda-forge/osx-arm64/libzlib-1.3.1-h8359307_2.conda - conda: https://conda.anaconda.org/conda-forge/osx-arm64/ncurses-6.5-h5e97a16_3.conda - - conda: https://conda.anaconda.org/conda-forge/osx-arm64/openssl-3.6.1-hd24854e_0.conda + - conda: https://conda.anaconda.org/conda-forge/osx-arm64/openssl-3.6.1-hd24854e_1.conda - conda: https://conda.anaconda.org/conda-forge/noarch/pip-25.3-pyh145f28c_0.conda - conda: https://conda.anaconda.org/conda-forge/osx-arm64/python-3.14.2-h40d2674_101_cp314.conda - conda: https://conda.anaconda.org/conda-forge/noarch/python_abi-3.14-8_cp314.conda @@ -507,7 +507,7 @@ environments: - conda: https://conda.anaconda.org/conda-forge/osx-arm64/tk-8.6.13-h010d191_3.conda - conda: https://conda.anaconda.org/conda-forge/noarch/tzdata-2025c-hc9c84f9_1.conda - conda: https://conda.anaconda.org/conda-forge/osx-arm64/zstd-1.5.7-hbf9d68e_6.conda - - pypi: https://files.pythonhosted.org/packages/e2/67/3ae32a1ddae8d6c0da5e9b91f0df69fb1748ff41342010245c077e083815/conservedwatersearch-0.5.0-py3-none-any.whl + - pypi: https://files.pythonhosted.org/packages/b4/d1/ebe68f13ea1444025bd1b45854f1a59d8f06af3498702f4e00ebd4a0e33e/conservedwatersearch-0.5.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/fd/e1/3542a9cb596cadd76fcef413f19c79216e002623158befe6daa03dbfa88c/contourpy-1.3.3-cp314-cp314-macosx_11_0_arm64.whl - pypi: https://files.pythonhosted.org/packages/e7/05/c19819d5e3d95294a6f5947fb9b9629efb316b96de511b418c53d245aae6/cycler-0.12.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/b5/36/7fb70f04bf00bc646cd5bb45aa9eddb15e19437a28b8fb2b4a5249fac770/filelock-3.20.3-py3-none-any.whl @@ -542,7 +542,7 @@ environments: - conda: https://conda.anaconda.org/conda-forge/win-64/libmpdec-4.0.0-hfd05255_1.conda - conda: https://conda.anaconda.org/conda-forge/win-64/libsqlite-3.51.2-hf5d6505_0.conda - conda: https://conda.anaconda.org/conda-forge/win-64/libzlib-1.3.1-h2466b09_2.conda - - conda: https://conda.anaconda.org/conda-forge/win-64/openssl-3.6.1-hf411b9b_0.conda + - conda: https://conda.anaconda.org/conda-forge/win-64/openssl-3.6.1-hf411b9b_1.conda - conda: https://conda.anaconda.org/conda-forge/noarch/pip-25.3-pyh145f28c_0.conda - conda: https://conda.anaconda.org/conda-forge/win-64/python-3.14.2-h4b44e0e_101_cp314.conda - conda: https://conda.anaconda.org/conda-forge/noarch/python_abi-3.14-8_cp314.conda @@ -554,7 +554,7 @@ environments: - conda: https://conda.anaconda.org/conda-forge/win-64/vcomp14-14.44.35208-h818238b_34.conda - conda: https://conda.anaconda.org/conda-forge/win-64/zstd-1.5.7-h534d264_6.conda - pypi: https://files.pythonhosted.org/packages/d1/d6/3965ed04c63042e047cb6a3e6ed1a63a35087b6a609aa3a15ed8ac56c221/colorama-0.4.6-py2.py3-none-any.whl - - pypi: https://files.pythonhosted.org/packages/e2/67/3ae32a1ddae8d6c0da5e9b91f0df69fb1748ff41342010245c077e083815/conservedwatersearch-0.5.0-py3-none-any.whl + - pypi: https://files.pythonhosted.org/packages/b4/d1/ebe68f13ea1444025bd1b45854f1a59d8f06af3498702f4e00ebd4a0e33e/conservedwatersearch-0.5.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/7d/c2/57f54b03d0f22d4044b8afb9ca0e184f8b1afd57b4f735c2fa70883dc601/contourpy-1.3.3-cp314-cp314-win_amd64.whl - pypi: https://files.pythonhosted.org/packages/e7/05/c19819d5e3d95294a6f5947fb9b9629efb316b96de511b418c53d245aae6/cycler-0.12.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/b5/36/7fb70f04bf00bc646cd5bb45aa9eddb15e19437a28b8fb2b4a5249fac770/filelock-3.20.3-py3-none-any.whl @@ -613,12 +613,12 @@ environments: - conda: https://conda.anaconda.org/conda-forge/noarch/pip-25.3-pyh8b19718_0.conda - conda: https://conda.anaconda.org/conda-forge/linux-64/python-3.11.14-hd63d673_3_cpython.conda - conda: https://conda.anaconda.org/conda-forge/linux-64/readline-8.3-h853b02a_0.conda - - conda: https://conda.anaconda.org/conda-forge/noarch/setuptools-80.10.1-pyh332efcf_0.conda + - conda: https://conda.anaconda.org/conda-forge/noarch/setuptools-80.10.2-pyh332efcf_0.conda - conda: https://conda.anaconda.org/conda-forge/linux-64/tk-8.6.13-noxft_h366c992_103.conda - conda: https://conda.anaconda.org/conda-forge/noarch/tzdata-2025c-hc9c84f9_1.conda - conda: https://conda.anaconda.org/conda-forge/noarch/wheel-0.46.3-pyhd8ed1ab_0.conda - conda: https://conda.anaconda.org/conda-forge/linux-64/zstd-1.5.7-hb78ec9c_6.conda - - pypi: https://files.pythonhosted.org/packages/e2/67/3ae32a1ddae8d6c0da5e9b91f0df69fb1748ff41342010245c077e083815/conservedwatersearch-0.5.0-py3-none-any.whl + - pypi: https://files.pythonhosted.org/packages/b4/d1/ebe68f13ea1444025bd1b45854f1a59d8f06af3498702f4e00ebd4a0e33e/conservedwatersearch-0.5.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/5f/4b/6157f24ca425b89fe2eb7e7be642375711ab671135be21e6faa100f7448c/contourpy-1.3.3-cp311-cp311-manylinux_2_27_x86_64.manylinux_2_28_x86_64.whl - pypi: https://files.pythonhosted.org/packages/e7/05/c19819d5e3d95294a6f5947fb9b9629efb316b96de511b418c53d245aae6/cycler-0.12.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/b5/36/7fb70f04bf00bc646cd5bb45aa9eddb15e19437a28b8fb2b4a5249fac770/filelock-3.20.3-py3-none-any.whl @@ -654,16 +654,16 @@ environments: - conda: https://conda.anaconda.org/conda-forge/osx-64/libsqlite-3.51.2-hb99441e_0.conda - conda: https://conda.anaconda.org/conda-forge/osx-64/libzlib-1.3.1-hd23fc13_2.conda - conda: https://conda.anaconda.org/conda-forge/osx-64/ncurses-6.5-h0622a9a_3.conda - - conda: https://conda.anaconda.org/conda-forge/osx-64/openssl-3.6.1-hb6871ef_0.conda + - conda: https://conda.anaconda.org/conda-forge/osx-64/openssl-3.6.1-hb6871ef_1.conda - conda: https://conda.anaconda.org/conda-forge/noarch/packaging-26.0-pyhcf101f3_0.conda - conda: https://conda.anaconda.org/conda-forge/noarch/pip-25.3-pyh8b19718_0.conda - conda: https://conda.anaconda.org/conda-forge/osx-64/python-3.11.14-h74c2667_3_cpython.conda - conda: https://conda.anaconda.org/conda-forge/osx-64/readline-8.3-h68b038d_0.conda - - conda: https://conda.anaconda.org/conda-forge/noarch/setuptools-80.10.1-pyh332efcf_0.conda + - conda: https://conda.anaconda.org/conda-forge/noarch/setuptools-80.10.2-pyh332efcf_0.conda - conda: https://conda.anaconda.org/conda-forge/osx-64/tk-8.6.13-h7142dee_3.conda - conda: https://conda.anaconda.org/conda-forge/noarch/tzdata-2025c-hc9c84f9_1.conda - conda: https://conda.anaconda.org/conda-forge/noarch/wheel-0.46.3-pyhd8ed1ab_0.conda - - pypi: https://files.pythonhosted.org/packages/e2/67/3ae32a1ddae8d6c0da5e9b91f0df69fb1748ff41342010245c077e083815/conservedwatersearch-0.5.0-py3-none-any.whl + - pypi: https://files.pythonhosted.org/packages/b4/d1/ebe68f13ea1444025bd1b45854f1a59d8f06af3498702f4e00ebd4a0e33e/conservedwatersearch-0.5.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/91/2e/c4390a31919d8a78b90e8ecf87cd4b4c4f05a5b48d05ec17db8e5404c6f4/contourpy-1.3.3-cp311-cp311-macosx_10_9_x86_64.whl - pypi: https://files.pythonhosted.org/packages/e7/05/c19819d5e3d95294a6f5947fb9b9629efb316b96de511b418c53d245aae6/cycler-0.12.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/b5/36/7fb70f04bf00bc646cd5bb45aa9eddb15e19437a28b8fb2b4a5249fac770/filelock-3.20.3-py3-none-any.whl @@ -700,16 +700,16 @@ environments: - conda: https://conda.anaconda.org/conda-forge/osx-arm64/libsqlite-3.51.2-h1ae2325_0.conda - conda: https://conda.anaconda.org/conda-forge/osx-arm64/libzlib-1.3.1-h8359307_2.conda - conda: https://conda.anaconda.org/conda-forge/osx-arm64/ncurses-6.5-h5e97a16_3.conda - - conda: https://conda.anaconda.org/conda-forge/osx-arm64/openssl-3.6.1-hd24854e_0.conda + - conda: https://conda.anaconda.org/conda-forge/osx-arm64/openssl-3.6.1-hd24854e_1.conda - conda: https://conda.anaconda.org/conda-forge/noarch/packaging-26.0-pyhcf101f3_0.conda - conda: https://conda.anaconda.org/conda-forge/noarch/pip-25.3-pyh8b19718_0.conda - conda: https://conda.anaconda.org/conda-forge/osx-arm64/python-3.11.14-h18782d2_3_cpython.conda - conda: https://conda.anaconda.org/conda-forge/osx-arm64/readline-8.3-h46df422_0.conda - - conda: https://conda.anaconda.org/conda-forge/noarch/setuptools-80.10.1-pyh332efcf_0.conda + - conda: https://conda.anaconda.org/conda-forge/noarch/setuptools-80.10.2-pyh332efcf_0.conda - conda: https://conda.anaconda.org/conda-forge/osx-arm64/tk-8.6.13-h010d191_3.conda - conda: https://conda.anaconda.org/conda-forge/noarch/tzdata-2025c-hc9c84f9_1.conda - conda: https://conda.anaconda.org/conda-forge/noarch/wheel-0.46.3-pyhd8ed1ab_0.conda - - pypi: https://files.pythonhosted.org/packages/e2/67/3ae32a1ddae8d6c0da5e9b91f0df69fb1748ff41342010245c077e083815/conservedwatersearch-0.5.0-py3-none-any.whl + - pypi: https://files.pythonhosted.org/packages/b4/d1/ebe68f13ea1444025bd1b45854f1a59d8f06af3498702f4e00ebd4a0e33e/conservedwatersearch-0.5.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/0d/44/c4b0b6095fef4dc9c420e041799591e3b63e9619e3044f7f4f6c21c0ab24/contourpy-1.3.3-cp311-cp311-macosx_11_0_arm64.whl - pypi: https://files.pythonhosted.org/packages/e7/05/c19819d5e3d95294a6f5947fb9b9629efb316b96de511b418c53d245aae6/cycler-0.12.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/b5/36/7fb70f04bf00bc646cd5bb45aa9eddb15e19437a28b8fb2b4a5249fac770/filelock-3.20.3-py3-none-any.whl @@ -744,11 +744,11 @@ environments: - conda: https://conda.anaconda.org/conda-forge/win-64/liblzma-5.8.2-hfd05255_0.conda - conda: https://conda.anaconda.org/conda-forge/win-64/libsqlite-3.51.2-hf5d6505_0.conda - conda: https://conda.anaconda.org/conda-forge/win-64/libzlib-1.3.1-h2466b09_2.conda - - conda: https://conda.anaconda.org/conda-forge/win-64/openssl-3.6.1-hf411b9b_0.conda + - conda: https://conda.anaconda.org/conda-forge/win-64/openssl-3.6.1-hf411b9b_1.conda - conda: https://conda.anaconda.org/conda-forge/noarch/packaging-26.0-pyhcf101f3_0.conda - conda: https://conda.anaconda.org/conda-forge/noarch/pip-25.3-pyh8b19718_0.conda - conda: https://conda.anaconda.org/conda-forge/win-64/python-3.11.14-h0159041_3_cpython.conda - - conda: https://conda.anaconda.org/conda-forge/noarch/setuptools-80.10.1-pyh332efcf_0.conda + - conda: https://conda.anaconda.org/conda-forge/noarch/setuptools-80.10.2-pyh332efcf_0.conda - conda: https://conda.anaconda.org/conda-forge/win-64/tk-8.6.13-h6ed50ae_3.conda - conda: https://conda.anaconda.org/conda-forge/noarch/tzdata-2025c-hc9c84f9_1.conda - conda: https://conda.anaconda.org/conda-forge/win-64/ucrt-10.0.26100.0-h57928b3_0.conda @@ -757,7 +757,7 @@ environments: - conda: https://conda.anaconda.org/conda-forge/win-64/vcomp14-14.44.35208-h818238b_34.conda - conda: https://conda.anaconda.org/conda-forge/noarch/wheel-0.46.3-pyhd8ed1ab_0.conda - pypi: https://files.pythonhosted.org/packages/d1/d6/3965ed04c63042e047cb6a3e6ed1a63a35087b6a609aa3a15ed8ac56c221/colorama-0.4.6-py2.py3-none-any.whl - - pypi: https://files.pythonhosted.org/packages/e2/67/3ae32a1ddae8d6c0da5e9b91f0df69fb1748ff41342010245c077e083815/conservedwatersearch-0.5.0-py3-none-any.whl + - pypi: https://files.pythonhosted.org/packages/b4/d1/ebe68f13ea1444025bd1b45854f1a59d8f06af3498702f4e00ebd4a0e33e/conservedwatersearch-0.5.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/98/4b/9bd370b004b5c9d8045c6c33cf65bae018b27aca550a3f657cdc99acdbd8/contourpy-1.3.3-cp311-cp311-win_amd64.whl - pypi: https://files.pythonhosted.org/packages/e7/05/c19819d5e3d95294a6f5947fb9b9629efb316b96de511b418c53d245aae6/cycler-0.12.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/b5/36/7fb70f04bf00bc646cd5bb45aa9eddb15e19437a28b8fb2b4a5249fac770/filelock-3.20.3-py3-none-any.whl @@ -817,12 +817,12 @@ environments: - conda: https://conda.anaconda.org/conda-forge/noarch/pip-25.3-pyh8b19718_0.conda - conda: https://conda.anaconda.org/conda-forge/linux-64/python-3.12.12-hd63d673_2_cpython.conda - conda: https://conda.anaconda.org/conda-forge/linux-64/readline-8.3-h853b02a_0.conda - - conda: https://conda.anaconda.org/conda-forge/noarch/setuptools-80.10.1-pyh332efcf_0.conda + - conda: https://conda.anaconda.org/conda-forge/noarch/setuptools-80.10.2-pyh332efcf_0.conda - conda: https://conda.anaconda.org/conda-forge/linux-64/tk-8.6.13-noxft_h366c992_103.conda - conda: https://conda.anaconda.org/conda-forge/noarch/tzdata-2025c-hc9c84f9_1.conda - conda: https://conda.anaconda.org/conda-forge/noarch/wheel-0.46.3-pyhd8ed1ab_0.conda - conda: https://conda.anaconda.org/conda-forge/linux-64/zstd-1.5.7-hb78ec9c_6.conda - - pypi: https://files.pythonhosted.org/packages/e2/67/3ae32a1ddae8d6c0da5e9b91f0df69fb1748ff41342010245c077e083815/conservedwatersearch-0.5.0-py3-none-any.whl + - pypi: https://files.pythonhosted.org/packages/b4/d1/ebe68f13ea1444025bd1b45854f1a59d8f06af3498702f4e00ebd4a0e33e/conservedwatersearch-0.5.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/cc/8f/ec6289987824b29529d0dfda0d74a07cec60e54b9c92f3c9da4c0ac732de/contourpy-1.3.3-cp312-cp312-manylinux_2_27_x86_64.manylinux_2_28_x86_64.whl - pypi: https://files.pythonhosted.org/packages/e7/05/c19819d5e3d95294a6f5947fb9b9629efb316b96de511b418c53d245aae6/cycler-0.12.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/b5/36/7fb70f04bf00bc646cd5bb45aa9eddb15e19437a28b8fb2b4a5249fac770/filelock-3.20.3-py3-none-any.whl @@ -858,16 +858,16 @@ environments: - conda: https://conda.anaconda.org/conda-forge/osx-64/libsqlite-3.51.2-hb99441e_0.conda - conda: https://conda.anaconda.org/conda-forge/osx-64/libzlib-1.3.1-hd23fc13_2.conda - conda: https://conda.anaconda.org/conda-forge/osx-64/ncurses-6.5-h0622a9a_3.conda - - conda: https://conda.anaconda.org/conda-forge/osx-64/openssl-3.6.1-hb6871ef_0.conda + - conda: https://conda.anaconda.org/conda-forge/osx-64/openssl-3.6.1-hb6871ef_1.conda - conda: https://conda.anaconda.org/conda-forge/noarch/packaging-26.0-pyhcf101f3_0.conda - conda: https://conda.anaconda.org/conda-forge/noarch/pip-25.3-pyh8b19718_0.conda - conda: https://conda.anaconda.org/conda-forge/osx-64/python-3.12.12-h74c2667_2_cpython.conda - conda: https://conda.anaconda.org/conda-forge/osx-64/readline-8.3-h68b038d_0.conda - - conda: https://conda.anaconda.org/conda-forge/noarch/setuptools-80.10.1-pyh332efcf_0.conda + - conda: https://conda.anaconda.org/conda-forge/noarch/setuptools-80.10.2-pyh332efcf_0.conda - conda: https://conda.anaconda.org/conda-forge/osx-64/tk-8.6.13-h7142dee_3.conda - conda: https://conda.anaconda.org/conda-forge/noarch/tzdata-2025c-hc9c84f9_1.conda - conda: https://conda.anaconda.org/conda-forge/noarch/wheel-0.46.3-pyhd8ed1ab_0.conda - - pypi: https://files.pythonhosted.org/packages/e2/67/3ae32a1ddae8d6c0da5e9b91f0df69fb1748ff41342010245c077e083815/conservedwatersearch-0.5.0-py3-none-any.whl + - pypi: https://files.pythonhosted.org/packages/b4/d1/ebe68f13ea1444025bd1b45854f1a59d8f06af3498702f4e00ebd4a0e33e/conservedwatersearch-0.5.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/be/45/adfee365d9ea3d853550b2e735f9d66366701c65db7855cd07621732ccfc/contourpy-1.3.3-cp312-cp312-macosx_10_13_x86_64.whl - pypi: https://files.pythonhosted.org/packages/e7/05/c19819d5e3d95294a6f5947fb9b9629efb316b96de511b418c53d245aae6/cycler-0.12.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/b5/36/7fb70f04bf00bc646cd5bb45aa9eddb15e19437a28b8fb2b4a5249fac770/filelock-3.20.3-py3-none-any.whl @@ -904,16 +904,16 @@ environments: - conda: https://conda.anaconda.org/conda-forge/osx-arm64/libsqlite-3.51.2-h1ae2325_0.conda - conda: https://conda.anaconda.org/conda-forge/osx-arm64/libzlib-1.3.1-h8359307_2.conda - conda: https://conda.anaconda.org/conda-forge/osx-arm64/ncurses-6.5-h5e97a16_3.conda - - conda: https://conda.anaconda.org/conda-forge/osx-arm64/openssl-3.6.1-hd24854e_0.conda + - conda: https://conda.anaconda.org/conda-forge/osx-arm64/openssl-3.6.1-hd24854e_1.conda - conda: https://conda.anaconda.org/conda-forge/noarch/packaging-26.0-pyhcf101f3_0.conda - conda: https://conda.anaconda.org/conda-forge/noarch/pip-25.3-pyh8b19718_0.conda - conda: https://conda.anaconda.org/conda-forge/osx-arm64/python-3.12.12-h18782d2_2_cpython.conda - conda: https://conda.anaconda.org/conda-forge/osx-arm64/readline-8.3-h46df422_0.conda - - conda: https://conda.anaconda.org/conda-forge/noarch/setuptools-80.10.1-pyh332efcf_0.conda + - conda: https://conda.anaconda.org/conda-forge/noarch/setuptools-80.10.2-pyh332efcf_0.conda - conda: https://conda.anaconda.org/conda-forge/osx-arm64/tk-8.6.13-h010d191_3.conda - conda: https://conda.anaconda.org/conda-forge/noarch/tzdata-2025c-hc9c84f9_1.conda - conda: https://conda.anaconda.org/conda-forge/noarch/wheel-0.46.3-pyhd8ed1ab_0.conda - - pypi: https://files.pythonhosted.org/packages/e2/67/3ae32a1ddae8d6c0da5e9b91f0df69fb1748ff41342010245c077e083815/conservedwatersearch-0.5.0-py3-none-any.whl + - pypi: https://files.pythonhosted.org/packages/b4/d1/ebe68f13ea1444025bd1b45854f1a59d8f06af3498702f4e00ebd4a0e33e/conservedwatersearch-0.5.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/53/3e/405b59cfa13021a56bba395a6b3aca8cec012b45bf177b0eaf7a202cde2c/contourpy-1.3.3-cp312-cp312-macosx_11_0_arm64.whl - pypi: https://files.pythonhosted.org/packages/e7/05/c19819d5e3d95294a6f5947fb9b9629efb316b96de511b418c53d245aae6/cycler-0.12.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/b5/36/7fb70f04bf00bc646cd5bb45aa9eddb15e19437a28b8fb2b4a5249fac770/filelock-3.20.3-py3-none-any.whl @@ -948,11 +948,11 @@ environments: - conda: https://conda.anaconda.org/conda-forge/win-64/liblzma-5.8.2-hfd05255_0.conda - conda: https://conda.anaconda.org/conda-forge/win-64/libsqlite-3.51.2-hf5d6505_0.conda - conda: https://conda.anaconda.org/conda-forge/win-64/libzlib-1.3.1-h2466b09_2.conda - - conda: https://conda.anaconda.org/conda-forge/win-64/openssl-3.6.1-hf411b9b_0.conda + - conda: https://conda.anaconda.org/conda-forge/win-64/openssl-3.6.1-hf411b9b_1.conda - conda: https://conda.anaconda.org/conda-forge/noarch/packaging-26.0-pyhcf101f3_0.conda - conda: https://conda.anaconda.org/conda-forge/noarch/pip-25.3-pyh8b19718_0.conda - conda: https://conda.anaconda.org/conda-forge/win-64/python-3.12.12-h0159041_2_cpython.conda - - conda: https://conda.anaconda.org/conda-forge/noarch/setuptools-80.10.1-pyh332efcf_0.conda + - conda: https://conda.anaconda.org/conda-forge/noarch/setuptools-80.10.2-pyh332efcf_0.conda - conda: https://conda.anaconda.org/conda-forge/win-64/tk-8.6.13-h6ed50ae_3.conda - conda: https://conda.anaconda.org/conda-forge/noarch/tzdata-2025c-hc9c84f9_1.conda - conda: https://conda.anaconda.org/conda-forge/win-64/ucrt-10.0.26100.0-h57928b3_0.conda @@ -961,7 +961,7 @@ environments: - conda: https://conda.anaconda.org/conda-forge/win-64/vcomp14-14.44.35208-h818238b_34.conda - conda: https://conda.anaconda.org/conda-forge/noarch/wheel-0.46.3-pyhd8ed1ab_0.conda - pypi: https://files.pythonhosted.org/packages/d1/d6/3965ed04c63042e047cb6a3e6ed1a63a35087b6a609aa3a15ed8ac56c221/colorama-0.4.6-py2.py3-none-any.whl - - pypi: https://files.pythonhosted.org/packages/e2/67/3ae32a1ddae8d6c0da5e9b91f0df69fb1748ff41342010245c077e083815/conservedwatersearch-0.5.0-py3-none-any.whl + - pypi: https://files.pythonhosted.org/packages/b4/d1/ebe68f13ea1444025bd1b45854f1a59d8f06af3498702f4e00ebd4a0e33e/conservedwatersearch-0.5.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/19/e8/6026ed58a64563186a9ee3f29f41261fd1828f527dd93d33b60feca63352/contourpy-1.3.3-cp312-cp312-win_amd64.whl - pypi: https://files.pythonhosted.org/packages/e7/05/c19819d5e3d95294a6f5947fb9b9629efb316b96de511b418c53d245aae6/cycler-0.12.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/b5/36/7fb70f04bf00bc646cd5bb45aa9eddb15e19437a28b8fb2b4a5249fac770/filelock-3.20.3-py3-none-any.whl @@ -1022,7 +1022,7 @@ environments: - conda: https://conda.anaconda.org/conda-forge/linux-64/tk-8.6.13-noxft_h366c992_103.conda - conda: https://conda.anaconda.org/conda-forge/noarch/tzdata-2025c-hc9c84f9_1.conda - conda: https://conda.anaconda.org/conda-forge/linux-64/zstd-1.5.7-hb78ec9c_6.conda - - pypi: https://files.pythonhosted.org/packages/e2/67/3ae32a1ddae8d6c0da5e9b91f0df69fb1748ff41342010245c077e083815/conservedwatersearch-0.5.0-py3-none-any.whl + - pypi: https://files.pythonhosted.org/packages/b4/d1/ebe68f13ea1444025bd1b45854f1a59d8f06af3498702f4e00ebd4a0e33e/conservedwatersearch-0.5.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/4b/32/e0f13a1c5b0f8572d0ec6ae2f6c677b7991fafd95da523159c19eff0696a/contourpy-1.3.3-cp313-cp313-manylinux_2_27_x86_64.manylinux_2_28_x86_64.whl - pypi: https://files.pythonhosted.org/packages/e7/05/c19819d5e3d95294a6f5947fb9b9629efb316b96de511b418c53d245aae6/cycler-0.12.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/b5/36/7fb70f04bf00bc646cd5bb45aa9eddb15e19437a28b8fb2b4a5249fac770/filelock-3.20.3-py3-none-any.whl @@ -1067,7 +1067,7 @@ environments: - conda: https://conda.anaconda.org/conda-forge/osx-64/readline-8.3-h68b038d_0.conda - conda: https://conda.anaconda.org/conda-forge/osx-64/tk-8.6.13-h7142dee_3.conda - conda: https://conda.anaconda.org/conda-forge/noarch/tzdata-2025c-hc9c84f9_1.conda - - pypi: https://files.pythonhosted.org/packages/e2/67/3ae32a1ddae8d6c0da5e9b91f0df69fb1748ff41342010245c077e083815/conservedwatersearch-0.5.0-py3-none-any.whl + - pypi: https://files.pythonhosted.org/packages/b4/d1/ebe68f13ea1444025bd1b45854f1a59d8f06af3498702f4e00ebd4a0e33e/conservedwatersearch-0.5.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/68/35/0167aad910bbdb9599272bd96d01a9ec6852f36b9455cf2ca67bd4cc2d23/contourpy-1.3.3-cp313-cp313-macosx_10_13_x86_64.whl - pypi: https://files.pythonhosted.org/packages/e7/05/c19819d5e3d95294a6f5947fb9b9629efb316b96de511b418c53d245aae6/cycler-0.12.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/b5/36/7fb70f04bf00bc646cd5bb45aa9eddb15e19437a28b8fb2b4a5249fac770/filelock-3.20.3-py3-none-any.whl @@ -1113,7 +1113,7 @@ environments: - conda: https://conda.anaconda.org/conda-forge/osx-arm64/readline-8.3-h46df422_0.conda - conda: https://conda.anaconda.org/conda-forge/osx-arm64/tk-8.6.13-h010d191_3.conda - conda: https://conda.anaconda.org/conda-forge/noarch/tzdata-2025c-hc9c84f9_1.conda - - pypi: https://files.pythonhosted.org/packages/e2/67/3ae32a1ddae8d6c0da5e9b91f0df69fb1748ff41342010245c077e083815/conservedwatersearch-0.5.0-py3-none-any.whl + - pypi: https://files.pythonhosted.org/packages/b4/d1/ebe68f13ea1444025bd1b45854f1a59d8f06af3498702f4e00ebd4a0e33e/conservedwatersearch-0.5.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/96/e4/7adcd9c8362745b2210728f209bfbcf7d91ba868a2c5f40d8b58f54c509b/contourpy-1.3.3-cp313-cp313-macosx_11_0_arm64.whl - pypi: https://files.pythonhosted.org/packages/e7/05/c19819d5e3d95294a6f5947fb9b9629efb316b96de511b418c53d245aae6/cycler-0.12.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/b5/36/7fb70f04bf00bc646cd5bb45aa9eddb15e19437a28b8fb2b4a5249fac770/filelock-3.20.3-py3-none-any.whl @@ -1161,7 +1161,7 @@ environments: - conda: https://conda.anaconda.org/conda-forge/win-64/vc14_runtime-14.44.35208-h818238b_34.conda - conda: https://conda.anaconda.org/conda-forge/win-64/vcomp14-14.44.35208-h818238b_34.conda - pypi: https://files.pythonhosted.org/packages/d1/d6/3965ed04c63042e047cb6a3e6ed1a63a35087b6a609aa3a15ed8ac56c221/colorama-0.4.6-py2.py3-none-any.whl - - pypi: https://files.pythonhosted.org/packages/e2/67/3ae32a1ddae8d6c0da5e9b91f0df69fb1748ff41342010245c077e083815/conservedwatersearch-0.5.0-py3-none-any.whl + - pypi: https://files.pythonhosted.org/packages/b4/d1/ebe68f13ea1444025bd1b45854f1a59d8f06af3498702f4e00ebd4a0e33e/conservedwatersearch-0.5.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/18/0b/0098c214843213759692cc638fce7de5c289200a830e5035d1791d7a2338/contourpy-1.3.3-cp313-cp313-win_amd64.whl - pypi: https://files.pythonhosted.org/packages/e7/05/c19819d5e3d95294a6f5947fb9b9629efb316b96de511b418c53d245aae6/cycler-0.12.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/b5/36/7fb70f04bf00bc646cd5bb45aa9eddb15e19437a28b8fb2b4a5249fac770/filelock-3.20.3-py3-none-any.whl @@ -1223,7 +1223,7 @@ environments: - conda: https://conda.anaconda.org/conda-forge/linux-64/tk-8.6.13-noxft_h366c992_103.conda - conda: https://conda.anaconda.org/conda-forge/noarch/tzdata-2025c-hc9c84f9_1.conda - conda: https://conda.anaconda.org/conda-forge/linux-64/zstd-1.5.7-hb78ec9c_6.conda - - pypi: https://files.pythonhosted.org/packages/e2/67/3ae32a1ddae8d6c0da5e9b91f0df69fb1748ff41342010245c077e083815/conservedwatersearch-0.5.0-py3-none-any.whl + - pypi: https://files.pythonhosted.org/packages/b4/d1/ebe68f13ea1444025bd1b45854f1a59d8f06af3498702f4e00ebd4a0e33e/conservedwatersearch-0.5.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/04/5f/9ff93450ba96b09c7c2b3f81c94de31c89f92292f1380261bd7195bea4ea/contourpy-1.3.3-cp314-cp314-manylinux_2_27_x86_64.manylinux_2_28_x86_64.whl - pypi: https://files.pythonhosted.org/packages/e7/05/c19819d5e3d95294a6f5947fb9b9629efb316b96de511b418c53d245aae6/cycler-0.12.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/b5/36/7fb70f04bf00bc646cd5bb45aa9eddb15e19437a28b8fb2b4a5249fac770/filelock-3.20.3-py3-none-any.whl @@ -1269,7 +1269,7 @@ environments: - conda: https://conda.anaconda.org/conda-forge/osx-64/tk-8.6.13-h7142dee_3.conda - conda: https://conda.anaconda.org/conda-forge/noarch/tzdata-2025c-hc9c84f9_1.conda - conda: https://conda.anaconda.org/conda-forge/osx-64/zstd-1.5.7-h3eecb57_6.conda - - pypi: https://files.pythonhosted.org/packages/e2/67/3ae32a1ddae8d6c0da5e9b91f0df69fb1748ff41342010245c077e083815/conservedwatersearch-0.5.0-py3-none-any.whl + - pypi: https://files.pythonhosted.org/packages/b4/d1/ebe68f13ea1444025bd1b45854f1a59d8f06af3498702f4e00ebd4a0e33e/conservedwatersearch-0.5.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/72/8b/4546f3ab60f78c514ffb7d01a0bd743f90de36f0019d1be84d0a708a580a/contourpy-1.3.3-cp314-cp314-macosx_10_13_x86_64.whl - pypi: https://files.pythonhosted.org/packages/e7/05/c19819d5e3d95294a6f5947fb9b9629efb316b96de511b418c53d245aae6/cycler-0.12.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/b5/36/7fb70f04bf00bc646cd5bb45aa9eddb15e19437a28b8fb2b4a5249fac770/filelock-3.20.3-py3-none-any.whl @@ -1316,7 +1316,7 @@ environments: - conda: https://conda.anaconda.org/conda-forge/osx-arm64/tk-8.6.13-h010d191_3.conda - conda: https://conda.anaconda.org/conda-forge/noarch/tzdata-2025c-hc9c84f9_1.conda - conda: https://conda.anaconda.org/conda-forge/osx-arm64/zstd-1.5.7-hbf9d68e_6.conda - - pypi: https://files.pythonhosted.org/packages/e2/67/3ae32a1ddae8d6c0da5e9b91f0df69fb1748ff41342010245c077e083815/conservedwatersearch-0.5.0-py3-none-any.whl + - pypi: https://files.pythonhosted.org/packages/b4/d1/ebe68f13ea1444025bd1b45854f1a59d8f06af3498702f4e00ebd4a0e33e/conservedwatersearch-0.5.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/fd/e1/3542a9cb596cadd76fcef413f19c79216e002623158befe6daa03dbfa88c/contourpy-1.3.3-cp314-cp314-macosx_11_0_arm64.whl - pypi: https://files.pythonhosted.org/packages/e7/05/c19819d5e3d95294a6f5947fb9b9629efb316b96de511b418c53d245aae6/cycler-0.12.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/b5/36/7fb70f04bf00bc646cd5bb45aa9eddb15e19437a28b8fb2b4a5249fac770/filelock-3.20.3-py3-none-any.whl @@ -1365,7 +1365,7 @@ environments: - conda: https://conda.anaconda.org/conda-forge/win-64/vcomp14-14.44.35208-h818238b_34.conda - conda: https://conda.anaconda.org/conda-forge/win-64/zstd-1.5.7-h534d264_6.conda - pypi: https://files.pythonhosted.org/packages/d1/d6/3965ed04c63042e047cb6a3e6ed1a63a35087b6a609aa3a15ed8ac56c221/colorama-0.4.6-py2.py3-none-any.whl - - pypi: https://files.pythonhosted.org/packages/e2/67/3ae32a1ddae8d6c0da5e9b91f0df69fb1748ff41342010245c077e083815/conservedwatersearch-0.5.0-py3-none-any.whl + - pypi: https://files.pythonhosted.org/packages/b4/d1/ebe68f13ea1444025bd1b45854f1a59d8f06af3498702f4e00ebd4a0e33e/conservedwatersearch-0.5.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/7d/c2/57f54b03d0f22d4044b8afb9ca0e184f8b1afd57b4f735c2fa70883dc601/contourpy-1.3.3-cp314-cp314-win_amd64.whl - pypi: https://files.pythonhosted.org/packages/e7/05/c19819d5e3d95294a6f5947fb9b9629efb316b96de511b418c53d245aae6/cycler-0.12.1-py3-none-any.whl - pypi: https://files.pythonhosted.org/packages/b5/36/7fb70f04bf00bc646cd5bb45aa9eddb15e19437a28b8fb2b4a5249fac770/filelock-3.20.3-py3-none-any.whl @@ -1496,14 +1496,14 @@ packages: version: 0.4.6 sha256: 4f1d9991f5acc0ca119f9d443620b77f9d6b33703e51011c16baf57afb285fc6 requires_python: '>=2.7,!=3.0.*,!=3.1.*,!=3.2.*,!=3.3.*,!=3.4.*,!=3.5.*,!=3.6.*' -- pypi: https://files.pythonhosted.org/packages/e2/67/3ae32a1ddae8d6c0da5e9b91f0df69fb1748ff41342010245c077e083815/conservedwatersearch-0.5.0-py3-none-any.whl +- pypi: https://files.pythonhosted.org/packages/b4/d1/ebe68f13ea1444025bd1b45854f1a59d8f06af3498702f4e00ebd4a0e33e/conservedwatersearch-0.5.1-py3-none-any.whl name: conservedwatersearch - version: 0.5.0 - sha256: 688f84a983cfa098935efa008ab148cd4de38a8700c88659db117bebe9cb1ac2 + version: 0.5.1 + sha256: 09ba569e95dbf2a1759a0a5687cff800e3d06c6304d2e86425e7832680df3768 requires_dist: - numpy>=2.0.0 - scikit-learn>=1.3 - requires_python: '>=3.11' + requires_python: '>=3.10' - pypi: https://files.pythonhosted.org/packages/04/5f/9ff93450ba96b09c7c2b3f81c94de31c89f92292f1380261bd7195bea4ea/contourpy-1.3.3-cp314-cp314-manylinux_2_27_x86_64.manylinux_2_28_x86_64.whl name: contourpy version: 1.3.3 @@ -2660,6 +2660,7 @@ packages: - __glibc >=2.17,<3.0.a0 - libgcc >=14 license: MIT + license_family: MIT purls: [] size: 58592 timestamp: 1769456073053 @@ -2669,6 +2670,7 @@ packages: depends: - __osx >=10.13 license: MIT + license_family: MIT purls: [] size: 53583 timestamp: 1769456300951 @@ -2678,6 +2680,7 @@ packages: depends: - __osx >=11.0 license: MIT + license_family: MIT purls: [] size: 40979 timestamp: 1769456747661 @@ -2689,6 +2692,7 @@ packages: - vc >=14.3,<15 - vc14_runtime >=14.44.35208 license: MIT + license_family: MIT purls: [] size: 45831 timestamp: 1769456418774 @@ -4136,17 +4140,6 @@ packages: purls: [] size: 3164551 timestamp: 1769555830639 -- conda: https://conda.anaconda.org/conda-forge/osx-64/openssl-3.6.1-hb6871ef_0.conda - sha256: de9f6aec7fddefa37715e2673ce24bad6ab9bc195c6c6f47614f9c75ba293bf0 - md5: 104ba1e791b28d1a04faeb896e87070d - depends: - - __osx >=10.13 - - ca-certificates - license: Apache-2.0 - license_family: Apache - purls: [] - size: 2770167 - timestamp: 1769553156847 - conda: https://conda.anaconda.org/conda-forge/osx-64/openssl-3.6.1-hb6871ef_1.conda sha256: e02e5639b0e4d6d4fcf0f3b082642844fb5a37316f5b0a1126c6271347462e90 md5: 30bb8d08b99b9a7600d39efb3559fff0 @@ -4158,17 +4151,6 @@ packages: purls: [] size: 2777136 timestamp: 1769557662405 -- conda: https://conda.anaconda.org/conda-forge/osx-arm64/openssl-3.6.1-hd24854e_0.conda - sha256: 40dd43b328778c30ba9c6f48b923f8032aa3342e8027fe5b423a9771b0b3b9bc - md5: b35db9011af78cf49435ffbcb26db60d - depends: - - __osx >=11.0 - - ca-certificates - license: Apache-2.0 - license_family: Apache - purls: [] - size: 3098656 - timestamp: 1769551665046 - conda: https://conda.anaconda.org/conda-forge/osx-arm64/openssl-3.6.1-hd24854e_1.conda sha256: 361f5c5e60052abc12bdd1b50d7a1a43e6a6653aab99a2263bf2288d709dcf67 md5: f4f6ad63f98f64191c3e77c5f5f29d76 @@ -4180,19 +4162,6 @@ packages: purls: [] size: 3104268 timestamp: 1769556384749 -- conda: https://conda.anaconda.org/conda-forge/win-64/openssl-3.6.1-hf411b9b_0.conda - sha256: db552637937c0d56a2bbb280e3b0e8deb525fe136cf2b1e9ed104888fb0970da - md5: 5598dbe32e8771ba60ad391b000f1327 - depends: - - ca-certificates - - ucrt >=10.0.20348.0 - - vc >=14.3,<15 - - vc14_runtime >=14.44.35208 - license: Apache-2.0 - license_family: Apache - purls: [] - size: 9351207 - timestamp: 1769553475774 - conda: https://conda.anaconda.org/conda-forge/win-64/openssl-3.6.1-hf411b9b_1.conda sha256: 53a5ad2e5553b8157a91bb8aa375f78c5958f77cb80e9d2ce59471ea8e5c0bd6 md5: eb585509b815415bc964b2c7e11c7eb3 @@ -4756,7 +4725,7 @@ packages: license: MIT license_family: MIT purls: - - pkg:pypi/pip?source=compressed-mapping + - pkg:pypi/pip?source=hash-mapping size: 1177534 timestamp: 1762776258783 - pypi: https://files.pythonhosted.org/packages/54/20/4d324d65cc6d9205fabedc306948156824eb9f0ee1633355a8f7ec5c66bf/pluggy-1.6.0-py3-none-any.whl @@ -6957,17 +6926,17 @@ packages: - ruff>=0.12.0 ; extra == 'dev' - cython-lint>=0.12.2 ; extra == 'dev' requires_python: '>=3.11' -- conda: https://conda.anaconda.org/conda-forge/noarch/setuptools-80.10.1-pyh332efcf_0.conda - sha256: 89d5bb48047e7e27aa52a3a71d6ebf386e5ee4bdbd7ca91d653df9977eca8253 - md5: cb72cedd94dd923c6a9405a3d3b1c018 +- conda: https://conda.anaconda.org/conda-forge/noarch/setuptools-80.10.2-pyh332efcf_0.conda + sha256: f5fcb7854d2b7639a5b1aca41dd0f2d5a69a60bbc313e7f192e2dc385ca52f86 + md5: 7b446fcbb6779ee479debb4fd7453e6c depends: - python >=3.10 license: MIT license_family: MIT purls: - pkg:pypi/setuptools?source=compressed-mapping - size: 678025 - timestamp: 1768998156365 + size: 678888 + timestamp: 1769601206751 - pypi: https://files.pythonhosted.org/packages/b7/ce/149a00dd41f10bc29e5921b496af8b574d8413afcd5e30dfa0ed46c2cc5e/six-1.17.0-py2.py3-none-any.whl name: six version: 1.17.0 diff --git a/pixi.toml b/pixi.toml index af653ab..73df3be 100644 --- a/pixi.toml +++ b/pixi.toml @@ -15,7 +15,7 @@ scipy = ">=1.0.0" [feature.test.pypi-dependencies] pytest = "*" -ConservedWaterSearch = "==0.5.0" +ConservedWaterSearch = "==0.5.1" MDAnalysis = "==2.10.0" numpy = "==2.4.1" scipy = "==1.17.0"