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"Effect of atomic charge, solvation, entropy, and ligand protonation state ..."
Daniel P. Oehme, Robert T. C. Brownlee, David J. D. Wilson (2012)
- Daniel P. Oehme, Robert T. C. Brownlee, David J. D. Wilson:
Effect of atomic charge, solvation, entropy, and ligand protonation state on MM-PB(GB)SA binding energies of HIV protease. J. Comput. Chem. 33(32): 2566-2580 (2012)
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