We are pleased to announce the release of DOCK 6.11.
DOCK is a suite of programs for molecular docking.
The source code for DOCK 6.11 is available for download and free
for academic users at
http://dock.compbio.ucsf.edu/DOCK_6/index.htm
This is a release of the new descriptor-driven de novo design method
DOCK_D3N which takes advantage of the integration of the open source
toolkit RDKit into DOCK6. DOCK_D3N tailors ligand growth towards
desirable regions of chemical space by calculating cheminformatic
descriptors at each stage of ligand construction.
For full information on what is new in DOCK 6.11, please visit:
http://dock.compbio.ucsf.edu/DOCK_6/new_in_6.11.txt
Sincerely,
The DOCK Team
Please visit us at the DOCK Web site.
http://dock.compbio.ucsf.edu
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Received on Thu Nov 16 2023 - 12:30:02 PST
