Giacomo Bastianelli wrote:
Hi Tsjerk,
I have just fixed the problem of cyclic (manually deleted some bonds
that gromacs added...), I got everything ready for the minimization
step after genbox.
I run it and it says:
Program grompp, VERSION 3.3
Source code file: statutil.c, line: 549
Fatal error:
Double command line argument -c
Is there anything wrong with my inputs?
thanks a lot
yes. it is exactly what it says.
--
David.
________________________________________________________________________
David van der Spoel, PhD, Assoc. Prof., Molecular Biophysics group,
Dept. of Cell and Molecular Biology, Uppsala University.
Husargatan 3, Box 596, 75124 Uppsala, Sweden
phone: 46 18 471 4205 fax: 46 18 511 755
[EMAIL PROTECTED] [EMAIL PROTECTED] http://folding.bmc.uu.se
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