THE MOST CITED PAPERS

 

A Standard Set of Pericyclic Reactions of Hydrocarbons for the Benchmarking of Computational Methods: The Performance of ab Initio, Density Functional, CASSCF, CASPT2, and CBS-QB3 Methods for the Prediction of Activation Barriers, Reaction Energetics, and Transition State Geometries

Guner, V.; Khuong, K. S.; Leach, A. G.; Lee, P. S.; Bartberger, M. D.; Houk, K. N.
J. Phys. Chem. A 2003; 107(51); 11445-11459.

(CITED:77)

 

 

The Performance of the Handy/Cohen Functionals, OLYP and O3LYP, for the Computation of Hydrocarbon Pericyclic Reaction Activation Barriers

Guner, V. A.; Khuong, K. S.; Houk, K. N.; Chuma, A.; Pulay, P.
J. Phys. Chem. A.; (Article); 2004; 108(15); 2959-2965.  

(CITED:12)

 

Theoretical Evidence for Oxygenated Intermediates in the Reductive Cyclization of Nitrobenzenes
Davies, I. W.; Guner, V. A.; Houk, K. N.

Org. Lett. 2004; 6(5); 743-746.

(CITED:10)

 

PUBLICATIONS

 

 

2006

 

Diels-Alder Reactions of Cyclopentadiene and 9,10-Dimethylanthracene with Cyanoalkenes: The Performance of Density Functional Theory and Hartree-Fock Calculations for the Prediction of Substituent Effects

Jones, G. O.; Guner, V. A.; Houk, K. N.

J. Phys. Chem. A 2006; 110(4); 1216-1224.  

http://pubs.acs.org/cgi-bin/article.cgi/jpcafh/2006/110/i04/pdf/jp052055z.pdf

 

2005

 

 Antimicrobial Activity 4-Substituted-Styryl-2-Azetidinone

Sema Tan, Vildan Adar Güner, Aysun Ergene,

 Journal of Pharmaceutical Chemistry 2005, 2(1), 11-15.  

 

 

 

 

 

2004

 

Theoretical Evidence for Oxygenated Intermediates in the Reductive Cyclization of Nitrobenzenes
Davies, I. W.; Guner, V. A.; Houk, K. N.

Org. Lett. 2004; 6(5); 743-746.

http://pubs.acs.org/cgi-bin/article.cgi/orlef7/2004/6/i05/pdf/ol0364273.pdf

 

Demonstrating the Synergy of Synthetic, Mechanistic, and Computational Studies in a Regioselective Aniline Synthesis

Davies, I. W.; Marcoux, J.-F.; Kuethe, J. T.; Lankshear, M. D.; Taylor, J. D. O.; Tsou, N.; Dormer, P. G.; Hughes, D. L.; Houk, K. N.; Guner, V.

J. Org. Chem. 2004; 69(4); 1298-1308.

http://pubs.acs.org/cgi-bin/article.cgi/joceah/2004/69/i04/pdf/jo035677u.pdf

 

Computational Studies on the Electrocyclizations of 1-Amino-1,3,5-hexatrienes
Guner, V. A.; Houk, K. N.; Davies, I. W.

J. Org. Chem. 2004; 69(23); 8024-8028.

http://pubs.acs.org/cgi-bin/article.cgi/joceah/2004/69/i23/pdf/jo048540s.pdf

 

The Performance of the Handy/Cohen Functionals, OLYP and O3LYP, for the Computation of Hydrocarbon Pericyclic Reaction Activation Barriers

Guner, V. A.; Khuong, K. S.; Houk, K. N.; Chuma, A.; Pulay, P.
J. Phys. Chem. A.; (Article); 2004; 108(15); 2959-2965.  

http://pubs.acs.org/cgi-bin/article.cgi/jpcafh/2004/108/i15/pdf/jp0369286.pdf

 

2003

 

A Standard Set of Pericyclic Reactions of Hydrocarbons for the Benchmarking of Computational Methods: The Performance of ab Initio, Density Functional, CASSCF, CASPT2, and CBS-QB3 Methods for the Prediction of Activation Barriers, Reaction Energetics, and Transition State Geometries

Guner, V.; Khuong, K. S.; Leach, A. G.; Lee, P. S.; Bartberger, M. D.; Houk, K. N.
J. Phys. Chem. A 2003; 107(51); 11445-11459.

(CITED:77)

http://pubs.acs.org/cgi-bin/article.cgi/jpcafh/2003/107/i51/pdf/jp035501w.pdf

 

 

Crystal Structure of 3,3-Dichloro-N,4-diphenyl-4-benzoyl-2-azetidinone

Mehmet Kabak, Vildan Guner, Yalcin Elerman, Tahsin Nuri Durlu,

Analytical Sciences 2003, 19, 969-7.

http://wwwsoc.nii.ac.jp/jsac/analsci/abst19-06.html#0969

 

 

 

2002

 

Infrared Spectra and AM1 Calculations of N-Benzylideneanilines

Vildan Güner, Sevgi Bayarı

Spectroscopy Letters 2002, 35(1), 83-98.  

http://www.informaworld.com/smpp/content~content=a713733314~db=all~order=page

 

2001

 

A High Temperature Measurement with A Coupled Reactor-GC System

Nurettin Balcıoğlu, Vildan Güner

Instrumentation Science and Technology 2001, 29(3), 193-200.

http://www.informaworld.com/smpp/content~content=a713633706~db=all~order=page

 

Cystal Structure of 3,3-dichloro-N-p-methoxyphenyl-4-(2-phenylstryl)-2-azetidinone

Mehmet Kabak, Vildan Güner, Yalçın Elerman and Tahsin Nuri Durlu, “

Analytical Sciences 2001, 17(7), 909-910.

http://www.jsac.or.jp/cgi-bin/analsci/j-pdf/17/7/909/

 

2000

 

Structure and Conformation of 2,3,4-triphenyl-1-oxa-2-azabutadiene

Vildan Güner, Mehmet Kabak, Yalçın Elerman, “

 Journal of Molecular Structure 2000, 526, 151-157.

http://www.sciencedirect.com

 

 Synthesis and Antimicrobial Activity of 1,4-Diaryl-2-azetidinones

 Vildan Güner, Süleyman Yıldırır, Berrin Özçelik, Ufuk Abbasoğlu,

Farmaco 2000, 55(2),147-150.

 

N-(pChlorophenyl)-3,3-diphenyl-4-(b-phenylstyryl)azetidin-2-one

Mehmet Kabak, Yalçın Elerman, Vildan Güner, Tahsin Nuri Durlu,

Acta Cryst.C56 2000, e207-e208.

 

1999

 

 3,3-Dichloro-1,4-diphenyl-2-azetidinone

Mehmet Kabak, Yalçın Elerman, Vildan Güner, Süleyman Yıldırır, Tahsin Nuri Durlu,

Acta Crystallographica 1999, C55, 1511-1512.

 

 3,3-Dichloro-1-(p-chlorophenyl)-4-(p-methoxyphenyl)-2-azetidinone

Mehmet Kabak, Yalçın Elerman, Vildan Güner, Süleyman Yıldırır, Tahsin Nuri Durlu

Acta Cystallographia 1999, C55, 2115-2117.

 

 

1997

 

3,3-Dichloro-4-(4-chlorophenyl)-1-phenyl-2-azetidinone

Dinçer Ülkü, Filiz Ercan, Vildan Güner

Acta Crystallographica 1997, C53, 1945-1947.

 

1996

 

Crystal and Molecular Structure of 3,3-Dichlor-1-(p-chlorophenyl)-4-phenyl-2

azetidinone

Filiz Ercan, Dinçer Ülkü, Vildan Güner

Zeitschrift  Kristallographie 1996,211(10), 735-736.

 

 3,3-Dichloro-4-(p-methoxyphenyl)-1-phenyl-2-azetidinone

 Filiz Ercan, Dinçer Ülkü, Vildan Güner

Acta Crystallographica 1996, C52, 1779-1780.