Project Name | Stars | Downloads | Repos Using This | Packages Using This | Most Recent Commit | Total Releases | Latest Release | Open Issues | License | Language |
---|---|---|---|---|---|---|---|---|---|---|
Awesome Molecular Docking | 81 | a year ago | mit | |||||||
We would like to maintain a list of resources which aim to solve molecular docking and other closely related tasks. | ||||||||||
Pycontact | 34 | a year ago | 2 | September 01, 2020 | 23 | gpl-3.0 | Python | |||
Analysis of non-covalent interactions in MD trajectories | ||||||||||
Contact_map | 31 | 9 months ago | 12 | October 28, 2020 | 9 | lgpl-2.1 | Python | |||
Contact map analysis for biomolecules; based on MDTraj | ||||||||||
Longbow | 14 | 4 years ago | 7 | other | Python | |||||
Longbow is a tool for automating simulations on a remote HPC machine. Longbow is designed to mimic the normal way an application is run locally but allows simulations to be sent to powerful machines. | ||||||||||
Schrodinger_utils | 12 | 8 months ago | mit | Python | ||||||
Various integrations to the Schrodinger ecosystem. With major interest on analysis tools for Molecular Dynamics simulations run with Desmond. | ||||||||||
Optimus_bind_sample | 7 | 2 years ago | 8 | mit | Jupyter Notebook | |||||
Designed to optimize the time/accuracy trade-off in predicting the effects of mutations on protein-protein binding | ||||||||||
Mdms | 6 | 5 years ago | 4 | September 13, 2019 | mit | Python | ||||
MDMS: Molecular Dynamics Made Simple; Python program facilitating performing Molecular Dynamics simulations of proteins |