cc-ats
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Neural_Network
Neural_Network PublicPredicting atomization energies of organic molecules with DNN
Python
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- eo-tda Public
cc-ats/eo-tda’s past year of commit activity - qed-tddft Public
Quantum-electrodynamical Time-dependent Density Functional Theory Within Gaussian Atomic Basis
cc-ats/qed-tddft’s past year of commit activity - Tutorials Public
Introductions to AlphaFold, RoseTTAFold, and OmegaFold covered in the course CHEM5570-100 at the University of Oklahoma
cc-ats/Tutorials’s past year of commit activity - mlp_tutorial Public
cc-ats/mlp_tutorial’s past year of commit activity - physical_unit_conversion Public
cc-ats/physical_unit_conversion’s past year of commit activity - machine_learning_example Public
cc-ats/machine_learning_example’s past year of commit activity - deepmd-kit Public Forked from deepmodeling/deepmd-kit
A deep learning package for many-body potential energy representation and molecular dynamics
cc-ats/deepmd-kit’s past year of commit activity - pyscf Public
cc-ats/pyscf’s past year of commit activity
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