Stars
A. Alenaizan's restricted electrostatic potential (RESP) plugin to Psi4
Wheels for Python on Windows, linked to oneAPI MKL
Pymol-open-source wheels for Python on Windows
Implementation of Alphafold 3 in Pytorch
Chemical 2D structure editor application/applet based on the Chemistry Development Kit
Non-sequential structural alignment program for protein structure
Software for biomolecular electrostatics and solvation calculations
Diffusion-based all-atom protein generative model.
AlphaLink2: Integrating crosslinking MS data into Uni-Fold-Multimer
An open library for the analysis of molecular dynamics trajectories
Making Protein Design accessible to all via Google Colab!