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38 stars written in Python
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Graph Neural Network Library for PyTorch

Python 23,104 3,911 Updated Nov 7, 2025

Quickly rewrite git repository history (filter-branch replacement)

Python 11,041 872 Updated Nov 1, 2025

High accuracy RAG for answering questions from scientific documents with citations

Python 7,817 783 Updated Nov 6, 2025

Democratizing Deep-Learning for Drug Discovery, Quantum Chemistry, Materials Science and Biology

Python 6,311 1,929 Updated Nov 3, 2025

Simplified interface for TensorFlow (mimicking Scikit Learn) for Deep Learning

Python 3,169 440 Updated Aug 30, 2021

Make images look as if they are made out of 1x1 LEGO blocks

Python 3,168 194 Updated May 25, 2024

Implementation of Alphafold 3 from Google Deepmind in Pytorch

Python 1,572 204 Updated Sep 18, 2025

A console script that allows you to easily update multiple git repositories at once

Python 826 94 Updated Jun 9, 2025

Recipe for a General, Powerful, Scalable Graph Transformer

Python 795 142 Updated Jul 4, 2024

Chainer Chemistry: A Library for Deep Learning in Biology and Chemistry

Python 675 132 Updated Apr 20, 2023

OmegaFold Release Code

Python 601 87 Updated Dec 12, 2022

Python utilities for Manubot: Manuscripts, open and automated

Python 450 46 Updated Jul 20, 2024

Draw UpSet plots with Matplotlib

Python 370 76 Updated May 2, 2024

BEELINE: evaluation of algorithms for gene regulatory network inference

Python 197 58 Updated Oct 12, 2025

ChemNLP project

Python 165 46 Updated Nov 3, 2025

Official repository for the paper "Tranception: Protein Fitness Prediction with Autoregressive Transformers and Inference-time Retrieval"

Python 160 27 Updated Aug 24, 2023

LLM for Drug Editing, ICLR 2024

Python 153 9 Updated May 28, 2024

Generate a diff between two tabular datasets expressed in CSV files.

Python 132 31 Updated Feb 18, 2021

bioinformatics tools running on modal

Python 107 16 Updated Nov 2, 2025

A Text-guided Protein Design Framework, Nat Mach Intell 2025 (https://www.nature.com/articles/s42256-025-01011-z)

Python 95 8 Updated Jan 11, 2025
Python 65 2 Updated Jul 22, 2025

bioinformatics plotting and tools

Python 59 6 Updated Jun 3, 2024

Template job submissions using GPUs in CHTC

Python 50 16 Updated Nov 5, 2025

A tool for automated uploading and version management of scientific data to Zenodo

Python 39 11 Updated May 16, 2025

This repository contains ClassificaIO, a Python package that provides a graphical user interface (GUI) for machine learning algorithms from scikit-learn.

Python 39 9 Updated Jun 28, 2021

Dimensionality reduction for single cell RNA-seq data

Python 36 10 Updated Feb 9, 2020

High-Throughput Computing in Python, powered by HTCondor

Python 33 10 Updated Jan 8, 2024

This repository is the working directory for the Garnet-Forest bundle of python scripts for analyzing diverse forms of 'omic' data in a network context.

Python 31 21 Updated Jan 9, 2019
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