grits
A toolkit for working with coarse-grain systems
Installation
To install this package, run one of the following:
Usage Tracking
0.6.0
0.5.1
0.5.0
0.4.2
0.4.1
5 / 8 versions selected
Downloads (Last 6 months): 0
Description
GRiTS is a toolkit for working with coarse-grain systems. It uses mBuild https://mbuild.mosdef.org to build up molecules and SMILES https://www.daylight.com/dayhtml/doc/theory/theory.smiles.html chemical grammar to facilitate the mapping from fine-to-coarse and coarse-to-fine.
About
Summary
A toolkit for working with coarse-grain systems
Last Updated
Feb 12, 2026 at 23:22
License
GPL-3.0-or-later
Total Downloads
14.8K
Version Downloads
131
Supported Platforms
noarch
GitHub Repository
https://github.com/cmelab/gritsDocumentation
https://grits.readthedocs.io