Project Name | Stars | Downloads | Repos Using This | Packages Using This | Most Recent Commit | Total Releases | Latest Release | Open Issues | License | Language |
---|---|---|---|---|---|---|---|---|---|---|
Deepmd Kit | 1,303 | 2 | 3 months ago | 44 | October 27, 2023 | 44 | lgpl-3.0 | C++ | ||
A deep learning package for many-body potential energy representation and molecular dynamics | ||||||||||
Tensormol | 190 | 6 years ago | 1 | November 08, 2017 | 16 | gpl-3.0 | Python | |||
Tensorflow + Molecules = TensorMol | ||||||||||
Gdynet | 47 | 2 years ago | 1 | mit | Jupyter Notebook | |||||
Unsupervised learning of atomic scale dynamics from molecular dynamics. | ||||||||||
Mdsuite | 32 | 8 months ago | 3 | August 31, 2022 | 68 | epl-2.0 | Python | |||
A post-processing engine for particle simulations | ||||||||||
Hoomd Tf | 27 | 3 years ago | 8 | mit | Python | |||||
A plugin that allows the use of Tensorflow in Hoomd-Blue for GPU-accelerated ML+MD | ||||||||||
Encodermap | 24 | 7 months ago | 12 | November 19, 2019 | 1 | lgpl-3.0 | Python | |||
python library for dimensionality reduction |