Published January 7, 2025
| Version 0.5.3
Software
Open
openforcefield/openff-recharge: 0.5.3
Authors/Creators
- 1. Open Molecular Software Foundation
- 2. @OpenForceField, @MDAnalysis
- 3. @openforcefield
- 4. @openforcefield @omsf
Description
What's Changed
- [pre-commit.ci] pre-commit autoupdate by @pre-commit-ci in https://github.com/openforcefield/openff-recharge/pull/165
- Drop Python 3.9 by @mattwthompson in https://github.com/openforcefield/openff-recharge/pull/166
- [pre-commit.ci] pre-commit autoupdate by @pre-commit-ci in https://github.com/openforcefield/openff-recharge/pull/167
- Add memory specification to file by @lilyminium in https://github.com/openforcefield/openff-recharge/pull/170
- Expand bondi radii by @lilyminium in https://github.com/openforcefield/openff-recharge/pull/172
- Use new Pydantic v1 backdoor by @mattwthompson in https://github.com/openforcefield/openff-recharge/pull/174
- [pre-commit.ci] pre-commit autoupdate by @pre-commit-ci in https://github.com/openforcefield/openff-recharge/pull/176
- Bump codecov/codecov-action from 4 to 5 by @dependabot in https://github.com/openforcefield/openff-recharge/pull/178
- Bump mamba-org/setup-micromamba from 1 to 2 by @dependabot in https://github.com/openforcefield/openff-recharge/pull/175
- Upstream "multiprocessing for ESP rebuild" by @mattwthompson in https://github.com/openforcefield/openff-recharge/pull/177
- [pre-commit.ci] pre-commit autoupdate by @pre-commit-ci in https://github.com/openforcefield/openff-recharge/pull/179
Full Changelog: https://github.com/openforcefield/openff-recharge/compare/0.5.2...0.5.3
Files
openforcefield/openff-recharge-0.5.3.zip
Files
(571.9 kB)
| Name | Size | Download all |
|---|---|---|
|
md5:ed37857959cda565e8973375e58ebe78
|
571.9 kB | Preview Download |
Additional details
Related works
- Is supplement to
- Software: https://github.com/openforcefield/openff-recharge/tree/0.5.3 (URL)
Software
- Repository URL
- https://github.com/openforcefield/openff-recharge