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typed-argument-parser Public
Typed argument parser for Python
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gflownet Public
Forked from recursionpharma/gflownetGFlowNet library specialized for graph & molecular data
Python MIT License UpdatedJul 14, 2024 -
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admet_ai Public
Training and prediction scripts for Chemprop models trained on ADMET datasets
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chemfunc Public
Useful functions for working with small molecules
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dinov2 Public
Forked from facebookresearch/dinov2PyTorch code and models for the DINOv2 self-supervised learning method.
Jupyter Notebook Apache License 2.0 UpdatedOct 17, 2023 -
p_tqdm Public
Parallel processing with progress bars
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escape_embeddings Public
Modeling SARS-CoV-2 antigen escape from antibodies using pretrained protein language model embeddings.
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entry-cli Public
Forked from HergenrotherLab/entry-cliCommand line app for predicting bacterial accumulation
Python Other UpdatedJan 11, 2023 -
binding-ddg-predictor Public
Forked from HeliXonProtein/binding-ddg-predictoropen source repository
Python Apache License 2.0 UpdatedSep 19, 2022 -
tcr-bert Public
Forked from wukevin/tcr-bertLarge language modeling applied to T-cell receptor (TCR) sequences.
Jupyter Notebook Apache License 2.0 UpdatedJun 7, 2022 -
MCTS_Interpretability Public
Monte Carlo Tree Search for Interpreting Stress Conditions in Natural Language
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rapidcell Public
Forked from nvladimus/rapidcellMultiscale modeling of E.coli chemotaxis
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multiobj-rationale Public
Forked from wengong-jin/multiobj-rationaleMulti-Objective Molecule Generation using Interpretable Substructures (ICML 2020)
Python MIT License UpdatedApr 28, 2021 -
hgraph2graph Public
Forked from wengong-jin/hgraph2graphHierarchical Generation of Molecular Graphs using Structural Motifs
Python MIT License UpdatedApr 10, 2021 -
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chemprop-factor Public
Matrix factorization and deep learning for molecular property prediction
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chemprop-intro Public
An introduction to machine learning for chemical property prediction
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IntroML Public
A hands-on introduction to machine learning
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graphing_fleas Public
A 2-dimensional Turing Machine simulator
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clmtrackr Public
Forked from auduno/clmtrackrJavascript library for precise tracking of facial features via Constrained Local Models
JavaScript MIT License UpdatedSep 11, 2017 -
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