Re: amber-developers: Short_ene/clambda

From: Thomas Steinbrecher <steinbrt.scripps.edu>
Date: Tue, 13 Nov 2007 11:23:09 -0800 (PST)

Hi Mike,

you are right, clambda is no longer declared in short_ene. That is odd, I
certainly didnt take it out because the code included in ew_directe3.h
needs it. I will put it back in. It suprises me that amber even compiled
this way...

Regards,

Thomas

Dr. Thomas Steinbrecher
The Scripps Research Institute
10550 N. Torrey Pines Rd.
San Diego CA 92037, USA

On Thu, 8 Nov 2007, Crowley, Michael wrote:

> Hi Thomas,
> The trouble is that clambda is not in the dummy variables or declared in
> short_ene.
> As you say, you should resolve the discrepancy, happy traveling
> Mike
>
>
> On 11/8/07 1:39 AM, "steinbrt.scripps.edu" <steinbrt.scripps.edu> wrote:
>
>> Hi everyone,
>>
>> regarding clambda in short_ene, I put it there and I believe it is still
>> needed. Im travelling so I dont have the code in front of me, but iirc, in
>> short_ene.f ew_directe3/4.h are included, which have clambda dependent
>> formulas in them.
>>
>> I'll check that as soon as I'm back at Scripps.
>>
>> Kind Regards,
>>
>> Thomas
>>
>>
>
>
>
Received on Wed Nov 14 2007 - 06:07:50 PST
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