Labels
Labels
26 labels
- Functionality relating to polymer property calculations
- Change which breaks dependent code or workflows
- Something isn't working
- Deals with aromaticity, stereochemistry, and other chemical considerations
- Improvements or additions to documentation
- This issue or pull request already exists
- New feature or request
- Clarification needed from filer OR developer
- Functionality for force field parameter assignment and calculation
- Features relating to shapes and linear, affine, and rigid transformations
- Good for newcomers
- Extra attention is needed
- Addition which allow to support and communicate with an existing toolkit
- This doesn't seem right
- Target for 1.0
- target for MuPT 2.0
- Enhancement which speeds up some existing functionality
- Organization-wide policies for contributions
- Further information is requested
- Functionality for preparing templates for reactive MD simulations
- Pertaining to how MuPT represents molecular systems internally
- Issue has had no new activity for extended period of time
- This will not be worked on