Calculation of different energy values

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Calculation of different energy values

Postby s123 » Thu Jun 12, 2014 4:45 am

Hi,
I want to calculate Electrostatic energy, Van der waal's energy, internal energy of the ligand, Torsional free energy, etc
Is it possible to obtain these energy values in Pyrx 0.8, if yes, can anyone plz guide me...

Thanks..
Sandy
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