Seth Hayik: search on Z-Library

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1

A computational study of the formation of 1,3,2-dioxaborolane from the reaction of dihydroxy borane with 1,2-ethanediol

Krishna L Bhat, Seth Hayik, Joseph N Corvo, Damien M Marycz, Charles W Bock

Journal:

Journal of Molecular Structure: THEOCHEM

Year:

2004

Language:

english

File:

PDF, 359 KB

english, 2004

2

Mutagenicity of Aromatic and Heteroaromatic Amines and Related Compounds: A QSAR Investigation

Krishna L. Bhat, Seth Hayik, Les Sztandera, Charles W. Bock

Journal:

Molecular Informatics

Year:

2005

Language:

english

File:

PDF, 161 KB

english, 2005

3

QM/MM X-ray refinement of zinc metalloenzymes

Xue Li, Seth A. Hayik, Kenneth M. Merz Jr.

Journal:

Journal of Inorganic Biochemistry

Year:

2010

Language:

english

File:

PDF, 2.25 MB

english, 2010

4

Structure of 4-[4-(Dimethylamino)-Phenylazo] Benzeneboronic Acid and Its Cyclic Esters with D-Glucose: A Computational Study

Seth Hayik, Krishna L. Bhat, Charles W. Bock

Journal:

Structural Chemistry

Year:

2004

Language:

english

File:

PDF, 5.10 MB

english, 2004

5

Critical assessment of quantum mechanics based energy restraints in protein crystal structure refinement

Ning Yu, Xue Li, Guanglei Cui, Seth A. Hayik, Kenneth M. Merz Jr.

Journal:

Protein Science

Year:

2006

Language:

english

File:

PDF, 840 KB

english, 2006

6

Mixed Quantum Mechanics/Molecular Mechanics Scoring Function To Predict Protein−Ligand Binding Affinity

Hayik, Seth A., Dunbrack, Roland, Merz, Kenneth M.

Journal:

Journal of Chemical Theory and Computation

Year:

2010

Language:

english

File:

PDF, 309 KB

english, 2010

7

Assigning the Protonation States of the Key Aspartates in β-Secretase Using QM/MM X-ray Structure Refinement

Yu, Ning, Hayik, Seth A., Wang, Bing, Liao, Ning, Reynolds, Charles H., Merz, Kenneth M.

Journal:

Journal of Chemical Theory and Computation

Year:

2006

Language:

english

File:

PDF, 909 KB

english, 2006

8

A Combined QM/MM Poisson−Boltzmann Approach

Hayik, Seth A., Liao, Ning, Merz, Kenneth M.

Journal:

Journal of Chemical Theory and Computation

Year:

2008

Language:

english

File:

PDF, 192 KB

english, 2008

9

A computational study of the formation of a boron–oxygen–carbon linkage. The reaction of monohydroxy borane with methanol

Krishna L. Bhat, Seth Hayik, Charles W. Bock

Journal:

Journal of Molecular Structure: THEOCHEM

Year:

2003

Language:

english

File:

PDF, 295 KB

english, 2003

10

Mutagenicity of aminoazo dyes and their reductive-cleavage metabolites: a QSAR/QPAR investigation

Les Sztandera, Ashish Garg, Seth Hayik, Krishna L. Bhat, Charles W. Bock

Journal:

Dyes and Pigments

Year:

2003

Language:

english

File:

PDF, 623 KB

english, 2003

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