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Pull requests: openforcefield/openff-interchange

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Pull requests list

Discard other conformers when packing
#1111 opened Nov 15, 2024 by mattwthompson • Draft
3 tasks
1
Do not subtract tolerance from box size
#1110 opened Nov 15, 2024 by mattwthompson • Draft
3 tasks
1
Document Pydantic/Pint helpers
#1105 opened Nov 14, 2024 by mattwthompson Loading…
1 of 3 tasks
2
Consolidate Python config files
#1104 opened Nov 13, 2024 by mattwthompson Loading…
2
Added triclinic boxes for lammps
#1095 opened Nov 6, 2024 by wutobias Loading…
1 of 3 tasks
9
Migrate project to pixi
#1093 opened Nov 4, 2024 by mattwthompson • Draft
3 tasks
1
Fix JSON roundtrip after Interchange.from_openmm
#1089 opened Nov 1, 2024 by mattwthompson Loading…
3 of 4 tasks
2
Support importing (some) virtual sites in Interchange.from_openmm
#1081 opened Oct 21, 2024 by mattwthompson Loading…
6 tasks
0.4.2
1
1
Bump mamba-org/setup-micromamba from 1 to 2 dependencies Pull requests that update a dependency file
#1072 opened Oct 4, 2024 by dependabot bot Loading…
1
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