VSDocker: a tool for parallel high-throughput virtual screening using AutoDock on Windows-based computer clusters.
CONCLUSIONS
VSDocker is an original program that allows using AutoDock4 for optimized virtual ligand screening on computer clusters or multiprocessor workstations. This tool is the first implementation of parallel high-performance virtual screening of ligands for MS Windows-based computer systems.


BACKGROUND
VSDocker 2.0 is freely available for non-commercial use at http://www.bio.nnov.ru/projects/vsdocker2/


BACKGROUND
nikita.prakhov@gmail.com


BACKGROUND
Supplementary data are available at Bioinformatics online.
Prakhov
Nikita D
ND
Faculty of Biology, Nizhny Novgorod State University, 23 Gagarin Avenue, 603950 Nizhny Novgorod, Russia. nikita.prakhov@gmail.com
Chernorudskiy
Alexander L
AL
Gainullin
Murat R
MR
D000465:Algorithms; D019295:Computational Biology / Q000379:methods*; D003196:Computer Graphics; D008024:Ligands; D012984:Software
D008024:Ligands