Stars
Generate input parameters and coordinates for atomistic and coarse-grained simulations of polymers, ssDNA, and carbohydrates
Repository for the BoltzGen model
Official repository for the Boltz biomolecular interaction models
Toward High-Accuracy Open-Source Biomolecular Structure Prediction.
Plugin for folding sequences directly in PyMOL
User friendly and accurate binder design pipeline
Making Protein Design accessible to all via Google Colab!
Making Protein folding accessible to all!
Chai-1, SOTA model for biomolecular structure prediction
Google Colaboratory Notebooks for Computational Biochemistry
LABODOCK: A Colab-Based Molecular Docking Tools
An application for configuring and running simulations with OpenMM
High level API for using machine learning models in OpenMM simulations
CHARMM and AMBER forcefields for OpenMM (with small molecule support)
OpenMM is a toolkit for molecular simulation using high performance GPU code.
Command line tool providing BOSS generated OPLS-AA/CM1A(-LBCC) parameters for organic molecules and ligands.
This code adds custom-made amino acids to the GROMACS forcefield directory.
Cloud-based molecular simulations for everyone
Cloud-based molecular simulations for everyone