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alphafold Public
Forked from google-deepmind/alphafoldOpen source code for AlphaFold.
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mof-generation-at-scale Public
Forked from globus-labs/mof-generation-at-scaleCreate new MOFs by combining generative AI and simulation on HPC
Python MIT License UpdatedNov 28, 2023 -
moses Public
Forked from molecularsets/mosesMolecular Sets (MOSES): A Benchmarking Platform for Molecular Generation Models
Python MIT License UpdatedNov 20, 2023 -
data-general-text-code-web Public
Forked from TPC-AI/data-general-text-code-webMaterial relating to data-general-text-code-web
UpdatedAug 11, 2023 -
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molSimplify Public
Forked from hjkgrp/molSimplifymolSimplify code
Python GNU General Public License v3.0 UpdatedJan 20, 2023 -
state-spaces Public
Forked from state-spaces/s4Sequence Modeling with Structured State Spaces
Jupyter Notebook Apache License 2.0 UpdatedOct 26, 2022 -
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ResT Public
Forked from wofmanaf/ResTThis is an official implementation for "ResT: An Efficient Transformer for Visual Recognition".
Python Apache License 2.0 UpdatedSep 28, 2022 -
gnn_anl_gc_collab Public
Forked from vksastry/gnn_anl_gc_collabJupyter Notebook UpdatedSep 22, 2022 -
schnetpack Public
Forked from atomistic-machine-learning/schnetpackSchNetPack - Deep Neural Networks for Atomistic Systems
Python Other UpdatedJul 22, 2022 -
cubicgan_modified Public
Forked from williamyxl/cubicgan_modifiedModified from MilesZhao/CubicGAN
Python UpdatedJul 8, 2022 -
alphafold2 Public
Forked from lucidrains/alphafold2To eventually become an unofficial Pytorch implementation / replication of Alphafold2, as details of the architecture get released
Python MIT License UpdatedJul 5, 2022 -
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gemnet_pytorch Public
Forked from TUM-DAML/gemnet_pytorchGemNet model in PyTorch, as proposed in "GemNet: Universal Directional Graph Neural Networks for Molecules" (NeurIPS 2021)
Python Other UpdatedJun 15, 2022 -
torchmd-net Public
Forked from torchmd/torchmd-netNeural network potentials based on graph neural networks and equivariant transformers
Python MIT License UpdatedJun 3, 2022 -
rl-paper-study Public
Forked from utilForever/rl-paper-studyReinforcement Learning paper review study
MIT License UpdatedMay 30, 2022 -
pytorch_geometric Public
Forked from pyg-team/pytorch_geometricGraph Neural Network Library for PyTorch
Python MIT License UpdatedMay 29, 2022 -
PGCGM Public
Forked from MilesZhao/PGCGMSource code for generating materials with 20 space groups using PGCGM
Python MIT License UpdatedMay 18, 2022 -
alignn Public
Forked from usnistgov/alignnAtomistic Line Graph Neural Network
Python Other UpdatedApr 25, 2022 -
deep-learning-for-image-processing Public
Forked from WZMIAOMIAO/deep-learning-for-image-processingdeep learning for image processing including classification and object-detection etc.
Python UpdatedNov 3, 2021 -
large-scale-lm-tutorials Public
Forked from kmh4500/large-scale-lm-tutorialsLarge-scale language modeling tutorials with PyTorch
Jupyter Notebook Apache License 2.0 UpdatedOct 28, 2021 -
Mask_RCNN Public
Forked from matterport/Mask_RCNNMask R-CNN for object detection and instance segmentation on Keras and TensorFlow
Python Other UpdatedJun 27, 2021 -
ocp Public
Forked from FAIR-Chem/fairchemhttps://opencatalystproject.org/
Python MIT License UpdatedJun 9, 2021 -
amptorch Public
Forked from ulissigroup/amptorchAMPtorch: Atomistic Machine Learning Package (AMP) - PyTorch
C++ GNU General Public License v3.0 UpdatedMay 23, 2021 -
fast Public
Forked from bowman-lab/fastPython GNU Lesser General Public License v2.1 UpdatedMay 20, 2021