Ecosyste.ms: Issues
An open API service for providing issue and pull request metadata for open source projects.
GitHub / xchem/duck issues and pull requests
#5 - Update to use new openff rdkit parameterization
Pull Request -
State: open - Opened by simonbray over 4 years ago
- 1 comment
#4 - 0.1.0 release of OpenSource Duck
Pull Request -
State: closed - Opened by abradle over 5 years ago
- 1 comment
#3 - Integrate imaging - as suggested here
Issue -
State: open - Opened by abradle over 6 years ago
#2 - Test script that runs up to equlib.chk / md_1 / smd_1 and checks all ok
Issue -
State: closed - Opened by abradle over 6 years ago
#1 - Reconnecting triple breaks still needs fixing.
Issue -
State: open - Opened by abradle over 6 years ago