Re: [AMBER] parmchk problem

From: case <case.biomaps.rutgers.edu>
Date: Wed, 5 Aug 2009 17:36:27 +0100

On Tue, Aug 04, 2009, isaac sugden wrote:

>
> >parmchk -i bonded_tmm_1_rs_rs_rr.mol2 -fi mol2 -o
> bonded_tmm_1_rs_rs_rr.frcmod

First: how was the input mol2 file generated? (It needs to have been
constructed with antechamber.)

Second, please post the input mol2 file...it's not possible to figure out the
problem (no frcmod output) without more information.

....dac


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Received on Wed Aug 19 2009 - 20:33:31 PDT
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