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RESP model

Z1, P Cieplak, W D Cornell and P A Kolhnan 1993. A Well-Behaved Electrostatic Potential Based 5thod for Deriving Atomic Charges - The RESP Model. Journal of Physical Chemistry 97 10269-10280. sen H C, J P M Postma, W F van Gunsteren and J Hermans 1981. Interaction Models for Water in lation to Protein Hydration. In Pullman B (Editor). Intermolecular Forces. Dordrecht, Reidel, I. 331-342. [Pg.266]

J. M. Wang, P. Cieplak, and P. A. Kollmann, How well does a restrained electrostatic potential (RESP) model perform in calculating conformational energies of organic and biological molecules J. Comput. Chem. 21, 1049 1074 (2000). [Pg.52]

Well-Behaved Electrostatic Potential Based Method Using Charge Restraints for Deriving Atomic Charges The RESP Model. [Pg.32]

C. Bayly, P. Cieplak, W. Cornell, and P. A. Kollman, A well-behaved electrostatic potential based method using charge restraints for deriving atomic point changes The RESP model, J. Phys Chem. 97 10269 (1993). [Pg.341]

Bayly C1, P Cieplak, W D Cornell and P A Kollman 1993. A Well-Behaved Electrostatic Potential Based Method for Deriving Atomic Charges - The RESP Model. Journal of Physical Chemistry 97 10269-10280. [Pg.248]

Does a Restrained Electrostatic Potential (RESP) Model Perform in Calculating Conformational Energies of Organic and Biological Molecules ... [Pg.372]

Bayly Cl, Cieplak P, Cornell W, Kollman PA (1993) A well-behaved electrostatic potential based method susing charge restraints for deriving atomic charges the RESP model. J Phys Chem 97(40) 10269-10280... [Pg.136]

See other pages where RESP model is mentioned: [Pg.250]    [Pg.341]    [Pg.250]    [Pg.72]    [Pg.1923]   
See also in sourсe #XX -- [ Pg.3 , Pg.1923 ]



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