--- On Wed, 2/10/16, Mahnaz Mirsoltani <mirsolta...@yahoo.com> wrote:
> From: Mahnaz Mirsoltani <mirsolta...@yahoo.com>
> Subject: add parameter
> To: gmx-us...@gromacs.org
> Date: Wednesday, February 10, 2016, 1:14 AM
> Hi
> I want to add some bond parameters in ffbonded.itp file, and
> as I read in manual, unit of "kb" is "kj.mol-1.nm-2" and
> unit of "b0" is "nm". But I have these quantities with
> "kcal.mol-1.Å-2" and "Å". How do I convert these? Is it
> enough converting of kcal/mol to kj/mol for "kb" and "Å" to
> 'nm" for "b0"?
> Thanks
> Mah
--
Gromacs Users mailing list
* Please search the archive at
http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before posting!
* Can't post? Read http://www.gromacs.org/Support/Mailing_Lists
* For (un)subscribe requests visit
https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or send a
mail to gmx-users-requ...@gromacs.org.
