[gmx-users] how to solve the warning
Justin A. Lemkul
jalemkul at vt.edu
Mon May 25 04:55:29 CEST 2009
Jinyao Wang wrote:
> hi,gmx-user
>
> I make a molecule *.itp and force field parameters. When I run editconf and
> genbox to build a system,there are always a warning like this. "Warning:
> masses will be determined based on residue and atom names, this can deviate
> from the real mass of the atom type."
>
> I don't know how to solve the problem.
This is normal output. It is probably only relevant if doing more advanced
tricks with editconf, like -princ. For normal preparation of a box, there
should be no problem.
-Justin
>
> Jinyao Wang wangjy at ciac.jl.cn 2009-05-25
>
>
> ------------------------------------------------------------------------
>
> _______________________________________________ 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
--
========================================
Justin A. Lemkul
Ph.D. Candidate
ICTAS Doctoral Scholar
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080
http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin
========================================
More information about the gromacs.org_gmx-users
mailing list