Re: [gmx-users] Fw: query regarding pdb2gmx program for protein with metal and a ligand

2010-03-23 Thread Justin A. Lemkul
sonali dhindwal wrote: -- Sonali Dhindwal --- On *Sun, 21/3/10, sonali dhindwal //* wrote: From: sonali dhindwal Subject: query regarding pdb2gmx program for protein with metal and a ligand To: mail...@gromacs.org Date: Sunday, 21 March, 2010, 1:43 PM Hello Sir

Re: [gmx-users] Fw: query regarding pdb2gmx program for protein with metal and a ligand

2010-03-23 Thread Mark Abraham
On 23/03/2010 10:43 PM, sonali dhindwal wrote: See http://www.gromacs.org/Documentation/How-tos/Parametrization#Exotic_species Mark --- On *Sun, 21/3/10, sonali dhindwal //* wrote: From: sonali dhindwal Subject: query regarding pdb2gmx program for protein with metal and a liga

[gmx-users] Fw: query regarding pdb2gmx program for protein with metal and a ligand

2010-03-23 Thread sonali dhindwal
-- Sonali Dhindwal --- On Sun, 21/3/10, sonali dhindwal wrote: From: sonali dhindwal Subject: query regarding pdb2gmx program for protein with metal and a ligand To: mail...@gromacs.org Date: Sunday, 21 March, 2010, 1:43 PM Hello Sir/Madam, I am new to Gromacs, and o want to run molecular dy