Thanks for reply
> The Delta S value reported in the output file of MMPBSA is already
> multiplied by temperature.
>
> -Bill
>
> On Tue, Nov 8, 2011 at 4:05 AM, Sangita Kachhap <sangita.imtech.res.in>wrote:
>
>>
>> Its entropy calclulated in MMPBSA.
>>
>> > The nmode program, or specifically in MMPBSA of some kind?
>> >
>> > 2011/11/8 Sangita Kachhap <sangita.imtech.res.in>
>> >
>> >>
>> >> Hello all
>> >> I have one cuery regarding entropy calclulation by NMODE.
>> >>
>> >> Is DELTA S calulated by NMODE already multiplied with Temeprature in
>> >> output file?
>> >>
>> >> Sangita Kachhap
>> >> JRF
>> >> BIC,IMTECH
>> >> CHANDIGARH
>> >>
>> >> ______________________________________________________________________
>> >> सूक्ष्मजीव प्रौद्योगिकी संस्थान (वैज्ञानिक औद्योगिक अनुसंधान परिषद)
>> >> Institute of Microbial Technology (A CONSTITUENT ESTABLISHMENT OF CSIR)
>> >> सैक्टर 39 ए, चण्डीगढ़ / Sector 39-A, Chandigarh
>> >> पिन कोड/PIN CODE :160036
>> >> दूरभाष/EPABX :0172 6665 201-202
>> >>
>> >> _______________________________________________
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>> >>
>> >
>> >
>> >
>> > --
>> > Jason M. Swails
>> > Quantum Theory Project,
>> > University of Florida
>> > Ph.D. Candidate
>> > 352-392-4032
>> > _______________________________________________
>> > AMBER mailing list
>> > AMBER.ambermd.org
>> > http://lists.ambermd.org/mailman/listinfo/amber
>> >
>>
>>
>> Sangita Kachhap
>> JRF
>> BIC,IMTECH
>> CHANDIGARH
>>
>> ______________________________________________________________________
>> सूक्ष्मजीव प्रौद्योगिकी संस्थान (वैज्ञानिक औद्योगिक अनुसंधान परिषद)
>> Institute of Microbial Technology (A CONSTITUENT ESTABLISHMENT OF CSIR)
>> सैक्टर 39 ए, चण्डीगढ़ / Sector 39-A, Chandigarh
>> पिन कोड/PIN CODE :160036
>> दूरभाष/EPABX :0172 6665 201-202
>>
>> _______________________________________________
>> AMBER mailing list
>> AMBER.ambermd.org
>> http://lists.ambermd.org/mailman/listinfo/amber
>>
>
>
>
> --
> Bill Miller III
> Quantum Theory Project,
> University of Florida
> Ph.D. Graduate Student
> 352-392-6715
> _______________________________________________
> AMBER mailing list
> AMBER.ambermd.org
> http://lists.ambermd.org/mailman/listinfo/amber
>
Sangita Kachhap
JRF
BIC,IMTECH
CHANDIGARH
______________________________________________________________________
सूक्ष्मजीव प्रौद्योगिकी संस्थान (वैज्ञानिक औद्योगिक अनुसंधान परिषद)
Institute of Microbial Technology (A CONSTITUENT ESTABLISHMENT OF CSIR)
सैक्टर 39 ए, चण्डीगढ़ / Sector 39-A, Chandigarh
पिन कोड/PIN CODE :160036
दूरभाष/EPABX :0172 6665 201-202
_______________________________________________
AMBER mailing list
AMBER.ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber
Received on Tue Nov 08 2011 - 05:00:03 PST
