Dear Amber users
I am analyzing the chaperone domain I of the 1nlt pdb complex following
the procedure published in J. Chem. Inf. Model. 2011, 51, 69–82. The
final results is in the attached file.
My question is why the TdS is so strong that make the final dG positive.
Does the TdS should or shouldn’t be included in the final dG calculation.
How could I explain for this? Any comments are welcome
Regards,
Hector.
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Dr. Hector A. Baldoni
Departamento de Quimica
Universidad Nacional de San Luis
Chacabuco 917 (D5700BWS)
San Luis - Argentina
hbaldoni at unsl.edu.ar
Tel.:+54-(0)2652-423789 ext. 157
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Received on Fri Apr 01 2011 - 11:00:02 PDT
