[gmx-users] Re: Re: Polyglycine PDB file.
helstreak at hotmail.com
Mon Sep 13 00:31:14 CEST 2010
> If you simple replace HETATM with ATOM, i.e.:
> you shift all columns left by two characters. This is probably why, instead of
> reading GLY, pdb2gmx is reading Y only. The proper replacement would be:
> :1,$s/HETATM/ATOM /
> Note the two trailing spaces after ATOM.
Justin, adding the two spaces did the job. Thanks
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