v3.11.0
·
2848 commits
to trunk-patch
since this release
Added:
hoomd.md.Integrator.validate_groups
verifies that MD integration methods are applied to distinct subsets of the system and that those subsets consist of integrable particles (automatically called when attached) (#1466).
Changed:
hoomd.hpmc.compute.SDF
computes pressures for systems of concave and non-monotonic patch interactions (#1391).- Reorganize documentation contents to fit in the sidebar, including landing pages for tutorials and how-to guides (#1526).
Fixed:
- Improved readability of images in the documentation (#1521).
hoomd.write.Table
now raises a meaningful error when given incorrect logger categories (#1510).- Correctly document the 1/2 scaling factor in the pairwise virial computation (#1525).
thermalize_particle_momenta
now sets 0 velocity and angular momentum for rigid constituent particles (#1472).- Reduce likelihood of data corruption when writing GSD files (#1531).
- Clarify migration process for
hoomd.md.pair.ExpandedLJ
(#1501).
Deprecated:
- The
sdf
attribute ofhoomd.hpmc.compute.SDF
- usesdf_compression
(#1391).