ADL: Docking inside recptor / Screening using Cygwin on a PC
sargis at scripps.edu
Tue Mar 11 16:52:13 PDT 2008
David Crosby wrote:
> 2) I'm curious if anyone out there is screening virtual libraries
> using Windows XP and the Cygwin linux-like environment? The tutorial at the
> Autodock homepage has great instructions in a UNIX native environment, but
> I'm hoping someone out there may have some helpful tips on translating that
> protocol into the Cygwin environment. I'm primarily interested in screening
> the NCI's diversity set.
I have been working on a tool that should enable this.
PyRx is in its infancy; the first pre-alpha release will be available in a
couple of months.
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