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@fgrunewald fgrunewald released this 31 Jul 08:55
· 271 commits to master since this release
v0.9.3
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New Features & Updates

  • All modifications for all protonation states in Martini3 were added. Automatic detection of protonation states should work. Limited support for selected M2 force-fields has been added. Protonation state modifications are supported when mapping from AMBER or CHARMM #529

Bug Fixes

  • small lint of bin/martinize2 executable #532
  • a typo in pdb.py which caused DSSP to fail was fixed. Thank you @juminlee! #524

Contributors

juminlee
Assets 2