Similar repositories to TUM-DAML/gemnet_tf:
TUM-DAML/gemnet_tf
github
similar
google-research/tuning_playbook
github
similar
davkovacs/BOTNet-datasets
github
similar
bkmi/equivariant-benchmark
github
similar
openmm/openmm-ml
github
similar
TUM-DAML/synthetic_coordinates
github
similar
mir-group/allegro
github
similar
THGLab/NewtonNet
github
similar
TUM-DAML/gemnet_pytorch
github
similar
mir-group/pair_nequip
github
similar
shuix007/HMGNN
github
similar
kaist-amsg/Composition-Conditioned-Crystal-GAN
github
similar
xtalopt/XtalOpt
github
similar
MMunibas/PhysNet
github
similar
OUnke/SpookyNet
github
similar
pyscf/mpi4pyscf
github
similar
openmm/openmm-plumed
github
similar
Frank-LIU-520/DeepMoleNet
github
similar
zetayue/MXMNet
github
similar
torchmd/torchmd-net
github
similar
wengong-jin/abdockgen
github
similar
MGEdata/SuperalloyDigger
github
similar
ADicksonLab/wepy
github
similar
blondegeek/e3nn_tutorial
github
similar
risilab/cormorant
github
similar
drorlab/combind
github
similar
openmm/NNPOps
github
similar
atomistic-machine-learning/SchNOrb
github
similar
drorlab/gvp
github
similar
learningmatter-mit/NeuralForceField
github
similar
soumyasanyal/mt-cgcnn
github
similar
openpathsampling/openpathsampling
github
similar
usnistgov/alignn
github
similar
openforcefield/openff-forcefields
github
similar
NREL/nfp
github
similar
pekkosk/hotbit
github
similar
MLMI2-CSSI/foundry
github
similar
torchmd/mdgrad
github
similar
pengxingang/Pocket2Mol
github
similar
lucidrains/geometric-vector-perceptron
github
similar