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

A Light-Weight And Interpretable Molecular Docking Model

In-silico design pipeline for evaluating protein structure diffusion models.

Protein structure diffusion model for unconditional protein generation and motif scaffolding

Code associated with "Biophysical prediction of protein-peptide interactions and signaling networks using machine learning."

De Novo Protein Design by Equivariantly Diffusing Oriented Residue Clouds

Standardized data set for machine learning of protein structure

Website associated with the "Biophysical prediction of protein-peptide interactions and signaling networks using machine learning."

Recurrent Geometric Networks for end-to-end differentiable learning of protein structure