[gmx-users] Gromacs simulation of solid polymer
lzheng at me.rochester.edu
Thu Jul 17 19:28:01 CEST 2003
You may write your own .gro file directly. It works for SiO2. :)
On Thu, 17 Jul 2003 ysun at mie.utoronto.ca wrote:
>I am from mechanical background and plan to simulate deformation of epoxy
>polymer cubic cell in solid state (after curing) under external forces.
>How should define the residue name in PDB file for my simulation using Gromacs?
>For atom C, I had a Pdb fiel and residue name was 'UNK' but it iS not
>recognized by Gromacs? How should set?
>Thanks in advance!
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