Keith Callenberg wrote:
Hello gmx-users,
I wrote a script to perform a simulation on my Ubuntu 10.04 machine
running Gromacs 4.0.7. At the beginning of the script I convert the
system from pdb coordinates to gro using pdb2gmx. I am using the
GROMOS 45a3 forcefield, specified by -ff G45a3 and i
Hello gmx-users,
I wrote a script to perform a simulation on my Ubuntu 10.04 machine
running Gromacs 4.0.7. At the beginning of the script I convert the
system from pdb coordinates to gro using pdb2gmx. I am using the
GROMOS 45a3 forcefield, specified by -ff G45a3 and it works great.
pdb2gmx -f n
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