[gmx-users] Dear Lemkul

I could not find out what is wrong I tried add to add #include ions.itp and #ifdef but it is not successful. Fatal error: No such moleculetype SOL Please help me. I got stuck with this. Please. -- gmx-users mailing listgmx-users@gromacs.org

Re: [gmx-users] Dear Lemkul

Hi Ravi, SOL does not sound like an ion to me. You probably want to include the topology for a water model, like spc.itp It sounds like you're trying things without knowing what, the way you mention #include and #ifdef. Did you try the tutorial material already? Cheers, Tsjerk On Aug 12, 2011