Sep 242015
 

GeauxDock v2

:: DESCRIPTION

GeauxDock is an ultra-fast automated docking program, designed to predict how small ligands bind to pharmacologically relevant macromolecules. GeauxDock employs a novel hybrid force field and a Monte Carlo protocol for the efficient sampling of conformational space.

::DEVELOPER

The LONI Institute

:: SCREENSHOTS

n/a

:: REQUIREMENTS

  • Linux

:: DOWNLOAD

GeauxDock

:: MORE INFORMATION

Citation

GeauxDock: A novel approach for mixed-resolution ligand docking using a descriptor-based force field.
Ding Y, Fang Y, Feinstein WP, Ramanujam J, Koppelman DM, Moreno J, Brylinski M, Jarrell M.
J Comput Chem. 2015 Oct 15;36(27):2013-26. doi: 10.1002/jcc.24031. d

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