[gmx-users] Epsilon AA, Epsilon AB, Epsilon BB

Justin A. Lemkul jalemkul at vt.edu
Tue Aug 24 23:16:04 CEST 2010



KS Rotondi wrote:
> The link takes me to the Tab Potentials page, but using the latest 
> Firefox with Mac OS 10.5.8 there are gaps in the text but no functions 
> shown at the top of the page. E.g. generic form is:  several blank 
> lines, LJ form is: even more blank lines, etc.
> 

Looks like the LaTeX objects are broken again.  I'll see if I can't get them 
worked out, or otherwise just re-work the page.

-Justin

> 
> 
> On Aug 24, 2010, at 3:48 PM, Justin A. Lemkul wrote:
> 
>>
>>
>> Rohit Malshe wrote:
>>> Dear all, I want to use a system in which Epsilon AA = 1 and Epsilon 
>>> BB = 0.5.  But I want to use Epsilon AB = 1.5. How do I do that in 
>>> gromacs?
>>
>> http://www.gromacs.org/Documentation/How-tos/Tabulated_Potentials
>>
>> -Justin
>>
>> -- 
>> ========================================
>>
>> Justin A. Lemkul
>> Ph.D. Candidate
>> ICTAS Doctoral Scholar
>> MILES-IGERT Trainee
>> Department of Biochemistry
>> Virginia Tech
>> Blacksburg, VA
>> jalemkul[at]vt.edu | (540) 231-9080
>> http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin
>>
>> ========================================
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> 

-- 
========================================

Justin A. Lemkul
Ph.D. Candidate
ICTAS Doctoral Scholar
MILES-IGERT Trainee
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080
http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin

========================================



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