On Tue, 16 Aug 2016 08:09:37 -0400
David A Case <david.case.rutgers.edu> wrote:
> On Tue, Aug 16, 2016, Hannes Loeffler wrote:
>
> Can you construct a test case that works in amber12 but not in
> AmberTools16?
See attachment. Run with
parmchk2 -i test.mol2 -f mol2 -o test.frcmod -p
$AMBERHOME/dat/leap/parm/GLYCAM_06j.dat
Thanks,
Hannes.
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Content-Disposition: attachment; filename=test.mol2
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IFRFTVAK
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Received on Tue Aug 16 2016 - 07:00:03 PDT
