FE Flow

Recipes, utilities, and protocols for molecular free energy calculations using the openmmtools/perses and Open Free Energy toolkits

Name		Name	Last commit message	Last commit date
Latest commit History 54 Commits
.github/workflows		.github/workflows
devtools		devtools
docs		docs
feflow		feflow
.git-blame-ignore-revs		.git-blame-ignore-revs
.gitignore		.gitignore
.pre-commit-config.yaml		.pre-commit-config.yaml
CODE_OF_CONDUCT.md		CODE_OF_CONDUCT.md
LICENSE		LICENSE
MANIFEST.in		MANIFEST.in
README.md		README.md
pyproject.toml		pyproject.toml
readthedocs.yml		readthedocs.yml

Provide feedback