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Chai-1, SOTA model for biomolecular structure prediction

Python 980 130 Updated Sep 17, 2024

Open source implementation of AlphaFold3

Python 725 46 Updated Sep 16, 2024

The intelligent approach to therapeutic development, powered by AI

Python 1 Updated Jun 23, 2024
C 968 37 Updated Sep 13, 2024

PLAPT-Readme

Mathematica 1 Updated Sep 3, 2024

WaterGate: An Accessible Computational Analysis of Flooding Patterns

Mathematica 17 Updated Aug 23, 2024
Jupyter Notebook 7,349 523 Updated Jun 16, 2024

Codebase and CLI for PLAPT: A state-of-the-art protein-ligand binding affinity model for drug discovery

Mathematica 14 2 Updated Sep 16, 2024

Using Wolfram Alpha Language, I implemented a weighted cellular automata model that predicts water flow across a region.

Mathematica 4 Updated Oct 28, 2023