Ecosyste.ms: Issues
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GitHub / martimunicoy/peleffy issues and pull requests
#78 - Integrate method for the OPLS OBC parameters
Issue -
State: closed - Opened by martimunicoy almost 4 years ago
- 4 comments
Labels: enhancement
#77 - Check out input PDB files prior parameterizing
Issue -
State: closed - Opened by martimunicoy almost 4 years ago
- 2 comments
Labels: enhancement, good first issue
#76 - Missing charge module in conda package
Issue -
State: closed - Opened by cescgina almost 4 years ago
Labels: bug
#73 - OPLS2005 would not keep PDB atom names
Issue -
State: closed - Opened by martimunicoy almost 4 years ago
Labels: bug
#65 - Impact class needs to be tested
Issue -
State: closed - Opened by martimunicoy almost 4 years ago
- 4 comments
Labels: testing