[gmx-users] problem in running gromacs
Mark Abraham
Mark.Abraham at anu.edu.au
Sat Feb 21 14:40:59 CET 2009
nitu sharma wrote:
> Dear all,
>
> Thanks for solving my problem but again I have one
> more problem when I put the pdb2gmx command it shows error like this
>
> "Program pdb2gmx, VERSION 3.3.2
> Source code file: futil.c, line: 345
>
> File input/output error:
> eiwit.pdb
>
> I am downloading version 4.0.3 but why it shows 3.3.2 and what is the
Your environment still has your old installation of 3.3.2 in the PATH.
See http://wiki.gromacs.org/index.php/Installation.
> meaning of "File input/output error eiwit.pdb "
You're doing something wrong, but since you haven't told us your command
line, I'm not going to guess what you've done wrong.
Mark
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