Re: [AMBER] Parametrization of glycerol and desoxycorticosterone

From: David A Case <case.biomaps.rutgers.edu>
Date: Wed, 20 Aug 2014 14:32:57 -0400

On Wed, Aug 20, 2014, BATUHAN KAV wrote:
>
> ATOM 2068 C1 1CA A 247 -9.669 -30.195 -21.851 1.00 26.17
> ATOM 2069 C2 1CA A 247 -10.143 -29.383 -23.056 1.00 26.85

...etc

In addition to the problems Jason spotted, you will need to add hydrogens
to your pdb file before running antechamber.

....regards...dac


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Received on Wed Aug 20 2014 - 12:00:03 PDT
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