94 Repositories
openff-toolkit
383
protein-ligand-benchmark
216
openff-forcefields
180
openff-interchange
88
openff-bespokefit
72
openff-evaluator
58
openff-fragmenter
47
openff-recharge
40
qca-dataset-submission
36
smirnoff99Frosst
31
ccpbiosim-2023
31
openff-qcsubmit
27
cmiles
23
protein-ligand-benchmark-livecoms
22
ptm_prototype
21
openff-sage
21
smarty
20
smee
19
openff-nagl
19
open-forcefield-group
15
smirnoff-plugins
11
openforcefield-forcebalance
11
openff-pablo
11
open-forcefield-data
11
anything-goes
11
openff-units
10
openff-benchmark
10
ccpbiosim-2025
10
status
9
polymer_examples
9
descent
9
open-forcefield-tools
8
proteinbenchmark
7
openforcefield.org
7
yammbs
6
release-1-benchmarking
6
MiniDrugBank
6
bayes-implicit-solvent
6
2021-bespokefit-workshop
5
rdkit_ugm_2025_demo
4
protein-nmr-fit
4
2023-workshop-vignettes
4
review-protein-benchmark-datasets
3
rdkit_ugm_2024_demo
3
protein-param-fit
3
openff-sphinx-theme
3
openff-nagl-models
3
openff-models
3
openff-amber-ff-ports
3
nistdataselection
3