ParmEd v4.1.0

What's Changed

• set python_requires to >=3.8 by @njzjz in #1285
• switch out copy with deepcopy for structure.copy() method by @daico007 in #1290
• Drude psf where NUMANISO is zero by @florianjoerg in #1274
• lonepair refinement by @JohannesKarwou in #1266
• Set atomic number when applying a patch by @peastman in #1275
• Prefer patch versions that replace external bonds by @peastman in #1278
• Enable changing C4 terms in LJ pairs individually by @KevinMei-Github in #1277
• Fix an error with mdin changing by @swails in #1299
• Fix bug with adding positional restraints for OpenMM (#1301) by @nffaruk in #1302
• Fix bug with restart reporter for OpenMM minimization by @nffaruk in #1303
• Preserve formal charges from PDB and CIF files if present over templates by @swails in #1304

New Contributors

• @njzjz made their first contribution in #1285
• @daico007 made their first contribution in #1290
• @florianjoerg made their first contribution in #1274
• @JohannesKarwou made their first contribution in #1266
• @KevinMei-Github made their first contribution in #1277
• @nffaruk made their first contribution in #1302

Full Changelog: 4.0.0...4.1.0