Dear All usres:
I am trying to do a simple system that contains 4 molecules ethane and
MD run using GROMACS. I build my .pdb file by using Avogadro software
. Afterwards, I try to generate the topology and .gro file using
pdb2gmx program and it generates an error. I am using the 43a1 force
field.
On 7/31/12 7:48 AM, Ali Alizadeh wrote:
Dear All usres:
I am trying to do a simple system that contains 4 molecules ethane and
MD run using GROMACS. I build my .pdb file by using Avogadro software
. Afterwards, I try to generate the topology and .gro file using
pdb2gmx program and it generates
Dear All usres:
I am trying to do a simple system that contains 4 molecules ethane and
MD run using GROMACS. I build my .pdb file by using Avogadro software
. Afterwards, I try to generate the topology and .gro file using
pdb2gmx program and it generates an error. I am using the 43a1 force
field.
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