[gmx-users] No addition of ions

Hi Gromacs users, Am running a MD simulation over a protein complex and before adding the ions. we run a grompp option then we get result as model net charge as some integer ie if +2.00. so we got to add 2 CL ions. But when i ran my protein for grompp it didnt give me any net charge so am not

Re: [gmx-users] No addition of ions

On 7/09/2011 4:14 PM, aiswarya pawar wrote: Hi Gromacs users, Am running a MD simulation over a protein complex and before adding the ions. we run a grompp option then we get result as model net charge as some integer ie if +2.00. so we got to add 2 CL ions. But when i ran my protein for