[gmx-users] get the mass having the atom type

[Erik Marklund]

Sebastian Waltz skrev:
> Hi all, 
>
> I am using the template.c file to make some individual
> analyses. Using top.atoms.atomtype[i] I can get the
> information of the atom type of atom i. Is it then possible
> to use this information to get the mass of this specific
> atom?
>
> Thanks a lot 
>   
top.atoms.atom[].m

-- 
-----------------------------------------------
Erik Marklund, PhD student
Dept. of Cell and Molecular Biology, Uppsala University.
Husargatan 3, Box 596,    75124 Uppsala, Sweden
phone:    +46 18 471 4537        fax: +46 18 511 755
erikm at xray.bmc.uu.se    http://folding.bmc.uu.se/