Conformational analysis of 14-membered macrolides using x-ray crystallography and molecular mechanics calculations

Thomas H. Keller; Edward G. Neeland; Steven. Rettig; James. Trotter; Larry. Weiler

doi:10.1021/ja00231a042

Conformational analysis of 14-membered macrolides using x-ray crystallography and molecular mechanics calculations

Journal of the American Chemical Society ◽

10.1021/ja00231a042 ◽

1988 ◽

Vol 110 (23) ◽

pp. 7858-7868 ◽

Cited By ~ 19

Author(s):

Thomas H. Keller ◽

Edward G. Neeland ◽

Steven. Rettig ◽

James. Trotter ◽

Larry. Weiler

Keyword(s):

Conformational Analysis ◽

Molecular Mechanics ◽

Molecular Mechanics Calculations ◽

X Ray ◽

X Ray Crystallography

ChemInform Abstract: Conformational Analysis of 14-Membered Macrolides Using X-Ray Crystallography and Molecular Mechanics Calculations.

ChemInform ◽

10.1002/chin.198909053 ◽

1989 ◽

Vol 20 (9) ◽

Author(s):

T. H. KELLER ◽

E. G. NEELAND ◽

S. RETTIG ◽

J. TROTTER ◽

L. WEILER

Keyword(s):

Conformational Analysis ◽

Molecular Mechanics ◽

Molecular Mechanics Calculations ◽

X Ray ◽

X Ray Crystallography

ChemInform Abstract: Conformational Analysis of 2-Aminotetralins: Molecular Mechanics Calculations, X-Ray Crystallography and NMR Spectroscopy.

ChemInform ◽

10.1002/chin.199410035 ◽

2010 ◽

Vol 25 (10) ◽

pp. no-no

Author(s):

A. KARLEN ◽

A. HELANDER ◽

A. M. JOHANSSON ◽

L. KENNE ◽

S. SUNDELL ◽

...

Keyword(s):

Nmr Spectroscopy ◽

Conformational Analysis ◽

Molecular Mechanics ◽

Molecular Mechanics Calculations ◽

X Ray ◽

X Ray Crystallography

ChemInform Abstract: Rotamers and Isomers in the Fulgide Series. Part 1. Stereochemistry and Conformational Analysis of Bis-(3,4-dimethoxybenzylidene)succinic Anhydrides by X-Ray Crystallography and Molecular Mechanics.

ChemInform ◽

10.1002/chin.198903052 ◽

1989 ◽

Vol 20 (3) ◽

Author(s):

J. C. A. BOEYENS ◽

L. DENNER ◽

G. W. PEROLD

Keyword(s):

Conformational Analysis ◽

Molecular Mechanics ◽

X Ray ◽

X Ray Crystallography

Conformational analysis of lipophilic antifolates: crystal and molecular structures of 6-substituted 5-adamantyl-2,4-diaminopyrimidines by x-ray analysis and molecular mechanics calculations

Journal of the American Chemical Society ◽

10.1021/ja00247a035 ◽

1987 ◽

Vol 109 (13) ◽

pp. 4053-4057 ◽

Cited By ~ 11

Author(s):

Vivian Cody ◽

Paul A. Sutton ◽

William J. Welsh

Keyword(s):

Conformational Analysis ◽

Molecular Mechanics ◽

Molecular Structures ◽

Molecular Mechanics Calculations ◽

X Ray ◽

Crystal And Molecular Structures

Structures of norbornane and dodecahedrane by molecular mechanics calculations (MM3), x-ray crystallography, and electron diffraction

Journal of the American Chemical Society ◽

10.1021/ja00185a048 ◽

1989 ◽

Vol 111 (3) ◽

pp. 1106-1114 ◽

Cited By ~ 60

Author(s):

N. L. Allinger ◽

H. J. Geise ◽

W. Pyckhout ◽

L. A. Paquette ◽

J. C. Gallucci

Keyword(s):

Electron Diffraction ◽

Molecular Mechanics ◽

Molecular Mechanics Calculations ◽

X Ray ◽

X Ray Crystallography

ChemInform Abstract: Conformational Study of N-Nitroso-2,6-diphenylpiperidines and N- Nitroso-2,6-diphenylpiperidin-4-ones by Molecular Mechanics Calculations, X-Ray Crystallography, and 1H and 13C NMR Spectroscopy.

ChemInform ◽

10.1002/chin.199614042 ◽

2010 ◽

Vol 27 (14) ◽

pp. no-no

Author(s):

M. GDANIEC ◽

M. J. MILEWSKA ◽

T. POLONSKI

Keyword(s):

Nmr Spectroscopy ◽

Molecular Mechanics ◽

13C Nmr ◽

13C Nmr Spectroscopy ◽

Conformational Study ◽

Molecular Mechanics Calculations ◽

1H And 13C Nmr ◽

X Ray ◽

X Ray Crystallography

Synthesis of new N2S2 ligands and Re(V)O(N2S2) analogues of 99mTc renal imaging agents. Characterization by NMR spectroscopy, molecular mechanics calculations, and X-ray crystallography

Inorganica Chimica Acta ◽

10.1016/s0020-1693(02)00960-x ◽

2002 ◽

Vol 339 ◽

pp. 327-340 ◽

Cited By ~ 19

Author(s):

Malgorzata Lipowska ◽

Lory Hansen ◽

Renzo Cini ◽

Xiaolong Xu ◽

Hoon Choi ◽

...

Keyword(s):

Nmr Spectroscopy ◽

Molecular Mechanics ◽

Imaging Agents ◽

Molecular Mechanics Calculations ◽

Renal Imaging ◽

X Ray ◽

X Ray Crystallography

Chiral polyhydroxylated tetrahydrothiophene derivatives: novel synthesis and structural elucidation by X-ray crystallography, NMR spectroscopy and molecular mechanics calculations

Journal of the Chemical Society Perkin Transactions 1 ◽

10.1039/p19930001255 ◽

1993 ◽

pp. 1255 ◽

Cited By ~ 5

Author(s):

A. V. Rama Rao ◽

K. Ashok Reddy ◽

N. R. Srinivas ◽

M. K. Gurjar ◽

N. Padmaja ◽

...

Keyword(s):

Nmr Spectroscopy ◽

Molecular Mechanics ◽

Structural Elucidation ◽

Molecular Mechanics Calculations ◽

X Ray ◽

X Ray Crystallography ◽

Novel Synthesis

ChemInform Abstract: Chiral Polyhydroxylated Tetrahydrothiophene Derivatives: Novel Synthesis and Structural Elucidation by X-Ray Crystallography, NMR Spectroscopy and Molecular Mechanics Calculations.

ChemInform ◽

10.1002/chin.199340182 ◽

2010 ◽

Vol 24 (40) ◽

pp. no-no

Author(s):

A. V. R. RAO ◽

K. A. REDDY ◽

N. R. SRINIVAS ◽

M. K. GURJAR ◽

N. PADMAJA ◽

...

Keyword(s):

Nmr Spectroscopy ◽

Molecular Mechanics ◽

Structural Elucidation ◽

Molecular Mechanics Calculations ◽

X Ray ◽

X Ray Crystallography ◽

Novel Synthesis

ChemInform Abstract: THE ACTION OF NITROGEN DIOXIDE AND NITRIC OXIDE ON HUMULENE, C15H24. ISOLATION AND CHARACTERIZATION BY X-RAY CRYSTALLOGRAPHY OF TWO DISTINCT CONFORMERS O HUMULENE NITROSITE. MOLECULAR MECHANICS CALCULATIONS FO 1,4,4,8,8,9-HEXAMETHYLCY

Chemischer Informationsdienst ◽

10.1002/chin.198348055 ◽

1983 ◽

Vol 14 (48) ◽

Author(s):

Z. F. KHAN ◽

D. K. MACALPINE ◽

A. L. PORTE ◽

G. A. SIM

Keyword(s):

Nitric Oxide ◽

Nitrogen Dioxide ◽

Molecular Mechanics ◽

Molecular Mechanics Calculations ◽

X Ray ◽

X Ray Crystallography ◽

Isolation And Characterization