[go: up one dir, main page]

Skip to content

repositories Search Results · topic:drug-discovery org:quantori fork:true

Filter by

7 results
 (221 ms)

7 results

inquantori (press backspace or delete to remove)

rDock is a fast and versatile Open Source docking program that can be used to dock small molecules against proteins and nucleic acids. T…
  • C++
  • 2
  • Updated
    on Dec 31, 2022

Docking Factory is a tool to automate molecular docking runs on an HPC cluster using the Dask framework. DockingFactory provides unified…
  • Python
  • 2
  • Updated
    on Jan 9, 2023

Docking Factory is a tool to automate molecular docking runs on an HPC cluster using the Dask framework. DockingFactory provides unified …
  • MATLAB
  • 1
  • Updated
    on Dec 31, 2022

Smina is fork of AutoDock Vina that is customized to better support scoring function development and high-performance energy minimization…
  • C++
  • 1
  • Updated
    on Dec 31, 2022

Quick Vina 2 is a fast and accurate molecular docking tool, attained at accurately accelerating AutoDock Vina. This fork of QVina 2 adds …
  • C++
  • 0
  • Updated
    on Dec 31, 2022

DockingInterface is a Python wrapper for open-source molecular docking programs: Autodock Vina, Smina, QVina2, and rDock.
  • MATLAB
  • 0
  • Updated
    on Dec 31, 2022

AutoDock Vina is one of the fastest and most widely used open-source docking engines. It is based on a simple scoring function and rapid …
  • C++
  • 0
  • Updated
    on Dec 31, 2022
Package icon

Sponsor open source projects you depend on

Contributors are working behind the scenes to make open source better for everyone—give them the help and recognition they deserve.Explore sponsorable projects
ProTip! 
Press the
/
key to activate the search input again and adjust your query.
Package icon

Sponsor open source projects you depend on

Contributors are working behind the scenes to make open source better for everyone—give them the help and recognition they deserve.Explore sponsorable projects
ProTip! 
Press the
/
key to activate the search input again and adjust your query.