Rigid-body docking and scoring by pyDock

PyDockWEB is a server for protein-protein docking using pyDock.
First, it generates rigid-body docking orientations by using an FFT-based method (Gabb et al. 1997 JMB 272, 106-120).
PyDockSER module (Cheng et al. Proteins. 2007 Aug 1;68(2):503-15.) will rescore the resulting docking poses by binding electrostatics and desolvation energy.

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Barcelona Supercomputing Center National Institute of Bioinformatics
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