Dear All,
I am using OPLSAA forcefield for generating methanol solvent
box. The methanol.pdb/methnaol216.gro that is available in /tutor
directory of gromacs is for united atom. Please tell me where I can get the
methanol coordinates for All Atom. Can I use *.gro file that can
Ravi Kumar Venkatraman wrote:
Dear All,
I am using OPLSAA forcefield for generating methanol
solvent box. The methanol.pdb/methnaol216.gro that is available in
/tutor directory of gromacs is for united atom. Please tell me
where I can get the methanol
2 matches
Mail list logo