On Mon, Jul 05, 2004, Guillaume Bollot wrote:
> I have a problem to converge a minimization with SANDER to AMBER7. After
> molecular dynamic, I want to minimize my antibody (3500 atoms) with the
> frame #275 from trajectory file with a treshold (0.5). I put my geometry
> from PTRAJ but the minimization done with the following message error:
> ...RESTARTED DUE TO LINMIN FAILURE.
Make sure you do not have SHAKE turned on, as well.
....dac
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Received on Mon Jul 05 2004 - 16:53:01 PDT
