protein-docking
There are 13 repositories under protein-docking topic.
PaddlePaddle/PaddleHelix
Bio-Computing Platform Featuring Large-Scale Representation Learning and Multi-Task Deep Learning “螺旋桨”生物计算工具集
RosettaCommons/PyRosetta.notebooks
Jupyter Notebooks for learning the PyRosetta platform for biomolecular structure prediction and design
lightdock/lightdock
Protein-protein, protein-peptide and protein-DNA docking framework based on the GSO algorithm
ketatam/DiffDock-PP
Implementation of DiffDock-PP: Rigid Protein-Protein Docking with Diffusion Models in PyTorch (ICLR 2023 - MLDD Workshop)
haddocking/arctic3d
Automatic Retrieval and ClusTering of Interfaces in Complexes from 3D structural information
gdocking/gdock
Protein-Protein Docking using Genetic Algorithm
Shen-Lab/BAL
Bayesian Active Learning for Optimization and Uncertainty Quantification with Applications to Protein Docking
sabifo4/VSpipe
VSpipe - A pipeline to carry out virtual screenings
thuxugang/opus_fold3
OPUS-Fold3: a gradient-based protein all-atom folding and docking framework on TensorFlow
colbyford/SARS-CoV-2_BA.2.86_Spike-RBD_Predictions
Predicting Antibody and ACE2 Affinity for SARS-CoV-2 BA.2.86 with In Silico Protein Modeling and Docking
tuplexyz/PD-1_Fab_Diffusion
PD-1 Targeted Antibody Discovery Using AI Protein Diffusion
zakimjz/ContextShapes
ContextShapes Algorithm for rigid-body protein shape matching and docking
cbstanley/docking
A set of molecular docking tools and analysis