We are pleased to announce the release of DOCK 6.5.
DOCK is a suite of programs for molecular docking.
In version 6.5 a new scoring function Descriptor Score is available.
It reports van der Waals and Coulombic energies, hydrogen bonds, and
per-residue energy decomposition comparisons with a reference molecule.
DOCK continues to provide a variety of other scoring methods including
grid based, PB/SA, and GB/SA, as well as a simple interface to
the AmberTools MD engine that enables receptor flexibility and
a complete MM force field.
For full information on what is new in DOCK 6.5, please visit:
http://dock.compbio.ucsf.edu/DOCK_6/new_in_6.5.txt
Sincerely,
The DOCK Team
Please visit us at the DOCK Web site.
http://dock.compbio.ucsf.edu
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Received on Mon Aug 01 2011 - 07:30:04 PDT
