Hi Eric,
> Hi, I tested the example01 with amber 7.0
> successfully. When I use mm_pbsa in my own case I can
> generate snapshots with NFREQ=1 only. I went back to
> the tutorial and found that the mdcrd file has a
> titile line CARNAL DUMP. Do I need to do anything
> similar to my trajectory generated from md
> simulations? Thanks.
>
> Eric
Your trajetory files only need to have the same title line in all cases
(which may be an empty line).
But you might want to see bugfix.22 at
http://amber.ch.ic.ac.uk/bugfixes70.html
Best regards
Holger
--
+++++++++++++++++++++++++++++++++++++++++++++
Dr. Holger Gohlke
Dept. of Molecular Biology, TPC15
The Scripps Research Institute
10550 N. Torrey Pines Rd.
La Jolla CA 92037 USA
phone: +1-858-784-9788
fax: +1-858-784-8896
email: gohlke_at_scripps.edu
+++++++++++++++++++++++++++++++++++++++++++++
Received on Tue Feb 04 2003 - 09:47:08 PST
