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Ultra-strict Python project template using uv, ruff, and basedpyright, inspired by TypeScript’s --strict mode.

189 9 Updated Apr 6, 2026

Open source implementation of AlphaFold3

Python 1,096 94 Updated Oct 7, 2024

Hera makes Python code easy to orchestrate on Argo Workflows through native Python integrations. It lets you construct and submit your Workflows entirely in Python. ⭐️ Remember to star!

Python 951 128 Updated Nov 4, 2026

Benchmarking framework for protein representation learning. Includes a large number of pre-training and downstream task datasets, models and training/task utilities. (ICLR 2024)

Python 280 22 Updated Oct 31, 2026

Official repository for DiffPepBuilder and DiffPepDock tools

Python 137 23 Updated Oct 24, 2025

Biological foundation modeling from molecular to genome scale

Python 1,588 186 Updated Mar 20, 2026

AlphaFold Meets Flow Matching for Generating Protein Ensembles

Python 547 85 Updated Mar 22, 2026

functorch is JAX-like composable function transforms for PyTorch.

Jupyter Notebook 1,434 108 Updated Aug 21, 2025

Trainable, memory-efficient, and GPU-friendly PyTorch reproduction of AlphaFold 2

Python 3,455 702 Updated Dec 16, 2025

the most goated babel plugin

JavaScript 989 61 Updated Apr 15, 2025

Pymolsnips is a library of PyMOL scripting language code fragments for several popular text editors.

Vim Snippet 43 4 Updated May 8, 2024
Python 11 3 Updated Mar 31, 2026

A simple implimentation of Bayesian Flow Networks (BFN)

Jupyter Notebook 239 15 Updated Jan 4, 2024

A comprehensive machine learning repository containing 30+ notebooks on different concepts, algorithms and techniques.

Jupyter Notebook 5,051 837 Updated Sep 22, 2023

🧑‍🏫 60+ Implementations/tutorials of deep learning papers with side-by-side notes 📝; including transformers (original, xl, switch, feedback, vit, ...), optimizers (adam, adabelief, sophia, ...), ga…

Python 67,750 6,789 Updated Nov 2, 2026

Practical Cheminformatics Tutorials

Jupyter Notebook 1,346 232 Updated Aug 22, 2026

Outpainting with Stable Diffusion on an infinite canvas

Python 3,890 290 Updated May 16, 2023

Bilingual Language Model for Protein Sequence and Structure

Jupyter Notebook 331 39 Updated Mar 6, 2026

Geometric GNN Dojo provides unified implementations and experiments to explore the design space of Geometric Graph Neural Networks (ICML 2023)

Jupyter Notebook 526 55 Updated Oct 9, 2025

Detailed and tailored guide for undergraduate students or anybody want to dig deep into the field of AI with solid foundation.

7,691 1,058 Updated Mar 14, 2024

Awesome resources on normalizing flows.

Python 1,644 130 Updated Jul 31, 2026

Python package for site-directed spin labeling of proteins

Python 15 4 Updated Jun 9, 2026

A Julia-based framework for molecular modelling

Julia 61 7 Updated Feb 11, 2024

Python code for Zernike polynomials

Python 181 47 Updated Jul 14, 2024
Python 16 5 Updated Sep 29, 2025

Import arbitrary code from Stack Overflow as Python modules.

Python 3,727 129 Updated Jan 9, 2022

List of papers about Proteins Design using Deep Learning

1,987 221 Updated Aug 15, 2026
Jupyter Notebook 2 Updated Sep 16, 2021
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