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A T Hagler

Showing results (1-10 of 40) with videos related to

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Journal of Computer-Aided Molecular Design|December 4, 2018
Force field development phase II: Relaxation of physics-based criteria… or inclusion of more rigorous physics into the representation of molecular energeticsA T Hagler
Journal of Chemical Theory and Computation|December 9, 2015
Quantum Derivative Fitting and Biomolecular Force Fields: Functional Form, Coupling Terms, Charge Flux, Nonbond Anharmonicity, and Individual Dihedral PotentialsA T Hagler
Nature|March 16, 1978
Computer simulation of the solvent structure around biological macromoleculesA T Hagler, J Moult
Journal of the American Chemical Society|August 21, 1974
Energy functions for peptides and proteins. II. The amide hydrogen bond and calculation of amide crystal propertiesA T Hagler, S Lifson
Biopolymers|June 1, 1976
Spatial electron distribution and population analysis of amides, carboxylic acid, and peptides, and their relation to empirical potential functionsA T Hagler, A Lapiccirella
Proceedings of the National Academy of Sciences of the United States of America|February 1, 1978
On the formation of protein tertiary structure on a computerA T Hagler, B Honig
Biochemistry|April 7, 2011
Mechanism of androgen receptor antagonism by bicalutamide in the treatment of prostate cancerD J Osguthorpe, A T Hagler
Journal of Computer-Aided Molecular Design|December 4, 2018
Biomolecular force fields: where have we been, where are we now, where do we need to go and how do we get there?Pnina Dauber-Osguthorpe, A T Hagler
Biochemistry|September 20, 1988
Catalysis of a rotational transition in a peptide by crystal forcesD H Kitson, A T Hagler
Biochemistry|July 12, 1988
Theoretical studies of the structure and molecular dynamics of a peptide crystalD H Kitson, A T Hagler
Pageof 4

Showing results (1-10 of 40) with videos related to

Sort By:
Pageof 4
Journal of Computer-Aided Molecular Design|December 4, 2018
Force field development phase II: Relaxation of physics-based criteria… or inclusion of more rigorous physics into the representation of molecular energeticsA T Hagler
Journal of Chemical Theory and Computation|December 9, 2015
Quantum Derivative Fitting and Biomolecular Force Fields: Functional Form, Coupling Terms, Charge Flux, Nonbond Anharmonicity, and Individual Dihedral PotentialsA T Hagler
Nature|March 16, 1978
Computer simulation of the solvent structure around biological macromoleculesA T Hagler, J Moult
Journal of the American Chemical Society|August 21, 1974
Energy functions for peptides and proteins. II. The amide hydrogen bond and calculation of amide crystal propertiesA T Hagler, S Lifson
Biopolymers|June 1, 1976
Spatial electron distribution and population analysis of amides, carboxylic acid, and peptides, and their relation to empirical potential functionsA T Hagler, A Lapiccirella
Proceedings of the National Academy of Sciences of the United States of America|February 1, 1978
On the formation of protein tertiary structure on a computerA T Hagler, B Honig
Biochemistry|April 7, 2011
Mechanism of androgen receptor antagonism by bicalutamide in the treatment of prostate cancerD J Osguthorpe, A T Hagler
Journal of Computer-Aided Molecular Design|December 4, 2018
Biomolecular force fields: where have we been, where are we now, where do we need to go and how do we get there?Pnina Dauber-Osguthorpe, A T Hagler
Biochemistry|September 20, 1988
Catalysis of a rotational transition in a peptide by crystal forcesD H Kitson, A T Hagler
Biochemistry|July 12, 1988
Theoretical studies of the structure and molecular dynamics of a peptide crystalD H Kitson, A T Hagler
Pageof 4