Re: [gmx-users] DPPC simulations

2008-11-25 Thread Justin A. Lemkul
Jenny Hsu wrote: Dear Justin: I try to include lipid.itp into ffgmxnb.itp and I also tried to add the different sections [ atomtypes ], [ pairtypes ], etc... of the lipid.itp files to ffgmx* files All you should have to do is copy all the sections of lipid.itp into ffgmxnb.itp, with the e

Re: [gmx-users] DPPC simulations

2008-11-25 Thread Jenny Hsu
Dear Justin: I try to include lipid.itp into ffgmxnb.itp and I also tried to add the different sections [ atomtypes ], [ pairtypes ], etc... of the lipid.itp files to ffgmx* files but when i run grompp, i got another fetal error "Atomtype 'C' not found" Jenny 2008/11/25 Justin A. Lemkul <[EMAIL

Re: [gmx-users] DPPC simulations

2008-11-25 Thread Justin A. Lemkul
Jenny Hsu wrote: Hi all when i run grompp but it gives "Atomtype LC3 not found" Could anyone explain me briefly? There's lots of information about this type of error in the list archives. Take, for example: http://www.gromacs.org/pipermail/gmx-users/2004-August/011867.html -Justin

[gmx-users] DPPC simulations

2008-11-25 Thread Jenny Hsu
Hi all when i run grompp but it gives "Atomtype LC3 not found" Could anyone explain me briefly? Jenny Hsu -- Jenny Hsu, Biotechnology Dept., Ming Chuan University, Taiwan, R.O.C ___ gmx-users mailing list