[gmx-users] methanol box

Soumendra Rana srana at chem.iitb.ac.in
Wed Oct 23 07:39:12 CEST 2002

Dear All,
       I wanna do simulation in a box of methanol.Am using the latest
version of gromacs.can anybody help me in this respect.Actually am a new
user.so i need an explanatory answer.The pdb2gmx program is not able to
generate the gro file for methanol pdb,when the force field option is
2.But when the option is 0,then it generates a gro file for the same.plz

Soumendra Rana
Research Scholar
BioOrganic Lab.
Dept.of Chemistry
IIT Bombay,Powai-400076
E-mail-soumendraR at netscape.net

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