Re: [gmx-users] water medium

2010-05-19 Thread tahereh tekieh
but genion only accepts one type of ion, how can we insert different types? On Tue, May 18, 2010 at 3:38 PM, Justin A. Lemkul jalem...@vt.edu wrote: tahereh tekieh wrote: dear friends i want to simulate a water medium in which 5 types of different ions flow in it. how can i do that with

Re: [gmx-users] water medium

2010-05-19 Thread Mark Abraham
- Original Message - From: tahereh tekieh golesan...@gmail.com Date: Wednesday, May 19, 2010 17:09 Subject: Re: [gmx-users] water medium To: jalem...@vt.edu, Discussion list for GROMACS users gmx-users@gromacs.org but genion only accepts one type of ion, how can we insert different

[gmx-users] water medium

2010-05-18 Thread tahereh tekieh
dear friends i want to simulate a water medium in which 5 types of different ions flow in it. how can i do that with gromacs? thanks -- gmx-users mailing listgmx-users@gromacs.org http://lists.gromacs.org/mailman/listinfo/gmx-users Please search the archive at http://www.gromacs.org/search

Re: [gmx-users] water medium

2010-05-18 Thread Justin A. Lemkul
tahereh tekieh wrote: dear friends i want to simulate a water medium in which 5 types of different ions flow in it. how can i do that with gromacs? thanks Assuming they are monoatomic, you can use genion after you have added water. If they are polyatomic, use genbox -ci -nmol (before