AMBER Archive (2003)

Subject: Re: one question

From: Holger Gohlke (gohlke_at_scripps.edu)
Date: Tue Jan 28 2003 - 10:17:02 CST

Hi,

yes, values given in the ..._statistics.out file are in kcal/mol.

Best regards

Holger

> What is the output energy unit from MM/PBSA?
> Kcal/mol
>
> Thanks,
>
> Fan
>
> ----------
> Fan Gao
>
> Dept. of Biomedical Engineering
> Receptor Biology Lab
> Medical Science Building 1-155
> Mayo Clinic
> Work Phone: 507-284-8461
>
> ---------- 

-- 
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Dr. Holger Gohlke
Dept. of Molecular Biology, TPC15
The Scripps Research Institute
10550 N. Torrey Pines Rd.
La Jolla CA 92037  USA
phone: +1-858-784-9788
fax:   +1-858-784-8896
email: gohlke_at_scripps.edu
+++++++++++++++++++++++++++++++++++++++++++++