Re: [AMBER] problem with sulphur

From: Mark Williamson <>
Date: Wed, 26 Oct 2011 13:20:50 +0100

David A Case wrote:
> K. Shahrokh, G. S. Yost, and T. E. Cheatham, III. "Quantum mechanically
> derived AMBER-compatible heme parameters for various states of the cytochrome
> P450 catalytic cycle." J. Comp. Chem. (2011) [in press].
> Prof. Cheatham might be able to provide more information.

Dear Pancham,

This is now available:



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Received on Wed Oct 26 2011 - 05:30:04 PDT
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