Hi John,
Thank you so much for your efforts - it's a great tutorial, in
particular compared to the somewhat old/crappy/undocumented ones we
provide in the distribution ;-)
Cheers,
Erik
On May 10, 2007, at 2:20 PM, John E. Kerrigan wrote:
Hi All,
I've updated the fwspider and drug-enzyme tutorials. The mdp files
have
been revised per Mark's excellent suggestion in regard to temperature
coupling groups. The Gromacs Biomolecular simulations workshop
recently
held this past February in Finland and now posted online (see
http://www.csc.fi/english/research/sciences/chemistry/courses/
gmx2007 )
was very helpful in the revision of these tutorials. I highly
recommend
the gromacs workshop at CSC.
A number of bugs and errors in the drug-enzyme tutorial have been
fixed.
Even still, these basic tutorials have become rather large and
unwieldy. There might still remain some typos and errors of
omission. I
hope not. Please do feel free to contact me if you find a bug or
error
and I will try to resolve quickly.
Thanks so much for your continued use of my tutorials and very helpful
input.
Regards,
John
<kerrigje.vcf>
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