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Pull requests: openforcefield/openff-interchange

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Pull requests list

[pre-commit.ci] pre-commit autoupdate
#1211 opened May 5, 2025 by pre-commit-ci bot Loading…
LAMMPS type labels
#1208 opened Apr 29, 2025 by benjamindjensen Loading…
3 tasks done
[WIP] Handle NAGLCharges
#1206 opened Apr 23, 2025 by j-wags • Draft
3 tasks
1
Added simple rounding error solution
#1167 opened Feb 12, 2025 by pbuslaev Loading…
3 tasks
1
14
[DNM] Try processing more constraints to LAMMPS input files
#1160 opened Feb 5, 2025 by mattwthompson • Draft
3 tasks
Added triclinic boxes for lammps
#1095 opened Nov 6, 2024 by wutobias Loading…
1 of 3 tasks
0.4.2
9
Migrate project to pixi
#1093 opened Nov 4, 2024 by mattwthompson • Draft
3 tasks
1
Support importing (some) virtual sites in Interchange.from_openmm
#1081 opened Oct 21, 2024 by mattwthompson Loading…
6 tasks
0.4.2
1
@mattwthompson
22
ProTip! What’s not been updated in a month: updated:<2025-04-11.