Re: [gmx-users] do_dssp: main chain

2007-05-23 Thread Florian Haberl
Hi, perhaps your .trr has some errors. Have you tried converting it or gmxcheck? Other solution could be: Transfer your protein residues to an multiple pdb file and try do_dssp again. Perhaps your top or ndx doesn't fit. On Wednesday, 23. May 2007 17:07, Volker Knecht wrote: > Dear all, > >

[gmx-users] do_dssp: main chain

2007-05-23 Thread Volker Knecht
Dear all, Message: 4 Date: Wed, 23 May 2007 10:16:59 -0400 From: Justin Lemkul <[EMAIL PROTECTED]> Subject: Re: [gmx-users] Re: Re: do_dssp for many peptides To: Discussion list for GROMACS users Message-ID: <[EMAIL PROTECTED]> Content-Type: text/plain; charset=ISO-8859-1 do_dssp claims tha