Update Rust crate hoomd-interaction to v1.1.0#9
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This PR contains the following updates:
1.0.0→1.1.0Release Notes
glotzerlab/hoomd-rs (hoomd-interaction)
v1.1.0Compare Source
Highlights:
hoomd-rs 1.1 adds a new shape type,
ConvexSurfaceMesh2d. Provide a set of points andConvexSurfaceMesh2dwill construct the vertices and edges of the convex hull. Intersection tests between twoConvexSurfaceMesh2dshapes take approximately half the time of intersection tests between twoConvex(ConvexPolygon)shapes. Therefore, you should preferConvexSurfaceMesh2dfor simulations of hard convex polygons. UseConvexPolygonwhen you have mixed shape types or are modeling spheropolygons.ConvexSurfaceMesh2dimplementsVolumeandIsPointInside, making it viable for use as a closed boundary condition.hoomd-rs 1.1 also adds
apply_with_filterand related methods toSweep. Useapply_with_filterto model systems where some bodies remain fixed in space. The new Seeded Self-Assembly tutorial demonstratesapply_with_filter.Added:
[hoomd-geometry]: AddConvexSurfaceMesh2dshape that stores the vertices and edges of a convex polygon. Initialize aConvexSurfaceMesh2das the convex hull of a point set (#259).[hoomd-geometry]: ImplementIntersectsAtforConvexSurfaceMesh2dintersection tests.The separating planes method is faster for small n than the Xenocollide
algorithm implemented for
Convex<ConvexPolygon>(#260).[hoomd-mc]: AddTuneOptionstype that describes move size tuning options (#268).[hoomd-mc]: AddedTune::tune_with_optionsassociated method that tunes trial move sizes with options passed viaTuneOptions(#268).[hoomd-mc]: AddedSweep::apply_with_filterassociated method that applies trial moves only to bodies that match a filter. For example, useapply_with_filterto keep a crystal seed fixed during the simulation (#268).[hoomd-mc]: AddedSweep::tune_with_options_and_filterassociated method that tunes trial move sizes while only applying trial moves to bodies that match a filter. Usetune_with_options_and_filterwith the same filter given toapply_with_filterto accurately tune move sizes (#268).[tutorial]: Added Seeded Self-Assembly tutorial (#268).Changed:
[benchmarks]: Adjust benchmark parameters to make accurate comparisons with HOOMD-blue (#260).[hoomd-geometry]: StoreConvexPolytopevertices using anArrayVecso thatConvexPolytopecan now be stored on the stack (#259).[hoomd-geometry]: Remove unnecessary trait bounds onIntersectsAtimplementation (#260).Deprecated:
[hoomd-mc]: DeprecatedTune::tune. Usetune_with_options(#268).[hoomd-mc]: DeprecatedTune::tune_default. Usetune_with_options(..., &TuneOptions::default())(#268).v1.0.2Compare Source
Fixed:
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