VSDocker: a tool for parallel high-throughput virtual screening using AutoDock on Windows-based computer clusters

VSDocker: a tool for parallel high-throughput virtual screening using AutoDock on Windows-based computer clusters
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DOI:
10.1093/bioinformatics/btq149
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发表时间:
2010-05-15
期刊:
影响因子:
5.8
通讯作者:
Gainullin, Murat R.
Gainullin, Murat R.
中科院分区:
生物学3区
文献类型:
--
作者:
Prakhov, Nikita D.;Chernorudskiy, Alexander L.;Gainullin, Murat R.

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VSDocker是一个原始程序,允许使用AutoDock4在计算机集群或多处理器工作站上进行优化的虚拟配体筛选。该工具是第一个实现的并行高性能虚拟筛选的配体MS Windows为基础的计算机系统。
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.