Toward automated assignment of nuclear magnetic resonance spectra:  pattern recognition in two-dimensional correlation spectra

Peter. Pfaendler; Geoffrey. Bodenhausen; Beat U. Meier; R. R. Ernst

doi:10.1021/ac00290a018

Toward automated assignment of nuclear magnetic resonance spectra: pattern recognition in two-dimensional correlation spectra

Analytical Chemistry ◽

10.1021/ac00290a018 ◽

1985 ◽

Vol 57 (13) ◽

pp. 2510-2516 ◽

Cited By ~ 84

Author(s):

Peter. Pfaendler ◽

Geoffrey. Bodenhausen ◽

Beat U. Meier ◽

R. R. Ernst

Keyword(s):

Nuclear Magnetic Resonance ◽

Pattern Recognition ◽

Magnetic Resonance ◽

Automated Assignment ◽

Two Dimensional ◽

Nuclear Magnetic Resonance Spectra ◽

Magnetic Resonance Spectra ◽

Nuclear Magnetic

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Pepto: An expert system for automatic peak assignment of two-dimensional nuclear magnetic resonance spectra of proteins

Journal of Computational Chemistry ◽

10.1002/jcc.540110704 ◽

1990 ◽

Vol 11 (7) ◽

pp. 805-818 ◽

Cited By ~ 17

Author(s):

Paolo Catasti ◽

Enrico Carrara ◽

Claudio Nicolini

Keyword(s):

Nuclear Magnetic Resonance ◽

Expert System ◽

Magnetic Resonance ◽

Two Dimensional ◽

Nuclear Magnetic Resonance Spectra ◽

Peak Assignment ◽

Magnetic Resonance Spectra ◽

Nuclear Magnetic

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Characterization of the stereochemical structure of poly(acrylic acid) by one- and two-dimensional 13C-1H nuclear magnetic resonance spectra

Polymer ◽

10.1016/0032-3861(95)90994-d ◽

1995 ◽

Vol 36 (21) ◽

pp. 4125-4130 ◽

Cited By ~ 27

Author(s):

Jirˇí Speˇvácˇek ◽

Milosˇ Suchopárek ◽

Saeed Al-Alawi

Keyword(s):

Nuclear Magnetic Resonance ◽

Magnetic Resonance ◽

Acrylic Acid ◽

Two Dimensional ◽

Stereochemical Structure ◽

Nuclear Magnetic Resonance Spectra ◽

1H Nuclear Magnetic Resonance ◽

Magnetic Resonance Spectra ◽

Nuclear Magnetic

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CSEARCH: a computer program for identification of organic compounds and fully automated assignment of carbon-13 nuclear magnetic resonance spectra

Journal of Chemical Information and Modeling ◽

10.1021/ci00046a010 ◽

1985 ◽

Vol 25 (2) ◽

pp. 103-108 ◽

Cited By ~ 84

Author(s):

Hermann Kalchhauser ◽

Wolfgang Robien

Keyword(s):

Nuclear Magnetic Resonance ◽

Magnetic Resonance ◽

Computer Program ◽

Organic Compounds ◽

Automated Assignment ◽

Nuclear Magnetic Resonance Spectra ◽

Magnetic Resonance Spectra ◽

Nuclear Magnetic

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Heuristic pattern recognition analysis of carbon-13 nuclear magnetic resonance spectra

Journal of the American Chemical Society ◽

10.1021/ja00820a020 ◽

1974 ◽

Vol 96 (13) ◽

pp. 4182-4185 ◽

Cited By ~ 29

Author(s):

Charles L. Wilkins ◽

Robert C. Williams ◽

Thomas R. Brunner ◽

Patrick J. McCombie

Keyword(s):

Nuclear Magnetic Resonance ◽

Pattern Recognition ◽

Magnetic Resonance ◽

Nuclear Magnetic Resonance Spectra ◽

Pattern Recognition Analysis ◽

Magnetic Resonance Spectra ◽

Nuclear Magnetic

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Determination of anomeric configuration of D-ribofuranosyl nucleosides from nuclear magnetic resonance spectra by a pattern recognition technique

Analytical Chemistry ◽

10.1021/ac60359a060 ◽

1975 ◽

Vol 47 (9) ◽

pp. 1702-1703 ◽

Cited By ~ 3

Author(s):

Jure. Zupan ◽

Joze. Kobe ◽

Dusan. Hadzi

Keyword(s):

Nuclear Magnetic Resonance ◽

Pattern Recognition ◽

Magnetic Resonance ◽

Pattern Recognition Technique ◽

Anomeric Configuration ◽

Nuclear Magnetic Resonance Spectra ◽

Recognition Technique ◽

Magnetic Resonance Spectra ◽

Nuclear Magnetic

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ChemInform Abstract: Synthesis, 31P Shift Correlated Two-Dimensional (COSY) Nuclear Magnetic Resonance Spectra, and Structure of the Tris(trimethyl phosphite)-Substituted Phosphido-Bridged Heteronuclear Dimer ((MeO)3P)2(CO)2Ru(μ-PPh2)Co(CO)2(P(OMe)3).

ChemInform ◽

10.1002/chin.198712305 ◽

1987 ◽

Vol 18 (12) ◽

Author(s):

S. GUESMI ◽

N. J. TAYLOR ◽

P. H. DIXNEUF ◽

A. J. CARTY

Keyword(s):

Nuclear Magnetic Resonance ◽

Magnetic Resonance ◽

Trimethyl Phosphite ◽

Two Dimensional ◽

Nuclear Magnetic Resonance Spectra ◽

Magnetic Resonance Spectra ◽

Nuclear Magnetic

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Analysis of 1H and 13C nuclear magnetic resonance spectra of spathulenol by two-dimensional methods

Journal of the Chemical Society Perkin Transactions 2 ◽

10.1039/p29850001773 ◽

1985 ◽

pp. 1773 ◽

Cited By ~ 26

Author(s):

Fuyihiko Inagaki ◽

Akira Abe

Keyword(s):

Nuclear Magnetic Resonance ◽

Magnetic Resonance ◽

Two Dimensional ◽

Nuclear Magnetic Resonance Spectra ◽

13C Nuclear Magnetic Resonance ◽

Magnetic Resonance Spectra ◽

Nuclear Magnetic

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High-resolution 31 P- 1 H two-dimensional Nuclear Magnetic Resonance spectra of unsonicated lipid mixtures spinning at the magic-angle

European Biophysics Journal ◽

10.1007/s002490050024 ◽

1996 ◽

Vol 25 (2) ◽

pp. 131-137 ◽

Cited By ~ 12

Author(s):

Dror E. Warschawski ◽

Pierre Fellmann ◽

P. F. Devaux

Keyword(s):

Nuclear Magnetic Resonance ◽

Magnetic Resonance ◽

High Resolution ◽

Magic Angle ◽

Two Dimensional ◽

Lipid Mixtures ◽

Nuclear Magnetic Resonance Spectra ◽

Magnetic Resonance Spectra ◽

Nuclear Magnetic

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400- and 750-MHz one- and two-dimensional nuclear magnetic resonance spectra of x-ray-degraded poly(methyl methacrylate): comparison with UV-degraded material

10.1117/12.309609 ◽

1998 ◽

Author(s):

Edward E. Waali ◽

John D. Scott ◽

Olga Vladimirsky ◽

Yuli Vladimirsky ◽

K. M. Hayataka ◽

...

Keyword(s):

Nuclear Magnetic Resonance ◽

Magnetic Resonance ◽

Methyl Methacrylate ◽

Two Dimensional ◽

X Ray ◽

Poly Methyl Methacrylate ◽

Nuclear Magnetic Resonance Spectra ◽

Degraded Material ◽

Magnetic Resonance Spectra ◽

Nuclear Magnetic

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Matrix decompositions of two-dimensional nuclear magnetic resonance spectra.

Proceedings of the National Academy of Sciences ◽

10.1073/pnas.91.17.7962 ◽

1994 ◽

Vol 91 (17) ◽

pp. 7962-7966 ◽

Cited By ~ 10

Author(s):

T. F. Havel ◽

I. Najfeld ◽

J. X. Yang

Keyword(s):

Nuclear Magnetic Resonance ◽

Magnetic Resonance ◽

Two Dimensional ◽

Matrix Decompositions ◽

Nuclear Magnetic Resonance Spectra ◽

Magnetic Resonance Spectra ◽

Nuclear Magnetic

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