[gmx-users] element symbol column in a pdb using editconf
Rebeca García Fandiño
regafan at hotmail.com
Tue Jul 7 16:15:39 CEST 2015
Dear Gromacs users,
I am trying to obtain a pdb file, using editconf, with the element symbol column.
Looking for that, I found this revision:
http://redmine.gromacs.org/issues/1307
It
seems to be resolved, however, I am using GROMACS 5.0.4 and it is not
working. Is there any way to retain the element symbol column in the
pdb using editconf?
Thanks a lot in advance,
Best wishes,
Dr. Rebeca Garcia
Santiago de Compostela University
Spain
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