[gmx-users] Partial Charge Units in GROMACS.

Yang Ye leafyoung at yahoo.com
Mon Sep 10 10:57:44 CEST 2007


yes.

On 9/10/2007 9:34 AM, Travis Trudeau wrote:
> My apologies if this question is rather elementary, but we are 
> uncertain what the units of partial charge are in GROMACS (i.e. in 
> library files like ffG43a1.rtp) - we are assuming they are units of 
> elementary charge ( i.e. charge of one electron/proton = 1)
>  
> Thank-you.
>  
> -Travis Trudeau
> ------------------------------------------------------------------------
>
> _______________________________________________
> gmx-users mailing list    gmx-users at gromacs.org
> http://www.gromacs.org/mailman/listinfo/gmx-users
> Please search the archive at http://www.gromacs.org/search before posting!
> Please don't post (un)subscribe requests to the list. Use the 
> www interface or send it to gmx-users-request at gromacs.org.
> Can't post? Read http://www.gromacs.org/mailing_lists/users.php



More information about the gromacs.org_gmx-users mailing list