Protex v1.2.0

New

Significant speedup for the calculation of updates. See mainly PR #68
Protex has the ability to create psf files without charmm (PR #90). Experimental!

What's Changed

• improved emoji by @JohannesKarwou in #72
• Clean up forcefield folder and testsystems.py by @florianjoerg in #71
• Docu HPTS by @florianjoerg in #73
• Update documentation by @florianjoerg in #74
• Patch drudeforce by @florianjoerg in #81
• patch resname by @florianjoerg in #80
• psf residues fix by @florianjoerg in #83
• thole particle_map by @florianjoerg in #84
• Tfa fixes by @florianjoerg in #82
• remove unnecessary extension, since parmed got an update by @florianjoerg in #92
• Create a psf file without charmm by @florianjoerg in #90
• speedup_newstuff by @florianjoerg in #94
• Speedup by @florianjoerg in #68
• removed unused 14 exclusion lists by @florianjoerg in #97

New Contributors

• @JohannesKarwou made their first contribution in #72

Full Changelog: v1.1.0...v1.2.0