cmiles
Generate canonical molecule identifiers for quantum chemistry
Installation
To install this package, run one of the following:
Installation commands are not available for this package.
Usage Tracking
0.1.6
0.1.5
2 / 8 versions selected
Downloads (Last 6 months): 0
About
Summary
Generate canonical molecule identifiers for quantum chemistry
Last Updated
Nov 18, 2020 at 18:56
License
MIT
GitHub Repository
https://github.com/openforcefield/cmilesDocumentation
https://cmiles.readthedocs.io/