[gmx-users] Atom X in residue YYY was not found in rtp fil
Dawid das
addiw7 at googlemail.com
Sat Feb 27 22:48:10 CET 2016
2016-02-27 22:42 GMT+01:00 Justin Lemkul <jalemkul at vt.edu>:
> Content is read by position, which is precisely your problem.
>
Yes, I am aware of that. By I did not change anything in position of my
*.pdb file.
I know that in different years the format changes somehow. The *.pdb file I
am using is from 1998.
The one I used before was 2005 or something. So probably the position was
moved by one.
Thanks anyway by reminding me that.
Best regards,
Dawid Grabarek
More information about the gromacs.org_gmx-users
mailing list