Hi,
I have a protein pdb file with ACE as N-cap and I am trying to use pdb2gmx (
within gromacs 4.5.4 ) to generate a topology file using opls/AA . the ACE is
present in opls aminoacids.rtp files. But, on issuing the pdb2gmx command, I
get following error message:
Program pdb2gmx_44, VERSION
Sanku M wrote:
Hi,
I have a protein pdb file with ACE as N-cap and I am trying to use
pdb2gmx ( within gromacs 4.5.4 ) to generate a topology file using
opls/AA . the ACE is present in opls aminoacids.rtp files. But, on
issuing the pdb2gmx command, I get following error message:
Program
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