openff-bespokefit
Automated tools for the generation of bespoke SMIRNOFF format parameters for individual molecules.
Installation
To install this package, run one of the following:
Usage Tracking
0.4.3
0.4.2
0.4.1
0.4.0
0.3.0
5 / 8 versions selected
Downloads (Last 6 months): 0
About
Summary
Automated tools for the generation of bespoke SMIRNOFF format parameters for individual molecules.
Last Updated
May 15, 2025 at 19:31
License
MIT
Total Downloads
37.9K
Supported Platforms
noarch
GitHub Repository
https://github.com/openforcefield/openff-bespokefit