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HSQC-ADEQUATE correlation: a new paradigm for establishing a molecular skeleton

Magnetic resonance in chemistry, 2011-05, Vol.49 (5), p.248-252

2011

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Blind trials of computer-assisted structure elucidation software

Journal of cheminformatics, 2012-02, Vol.4 (1), p.5-5, Article 5

2012

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Unequivocal determination of caulamidines A and B: application and validation of new tools in the structure elucidation tool box

Chemical science (Cambridge), 2018-01, Vol.9 (2), p.307-314

2018

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Unequivocal structure confirmation of a breitfussin analog by anisotropic NMR measurements

Chemical science (Cambridge), 2020-11, Vol.11 (44), p.1281-1288

2020

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Toward More Reliable 13C and 1H Chemical Shift Prediction: A Systematic Comparison of Neural-Network and Least-Squares Regression Based Approaches

Journal of chemical information and modeling, 2008-01, Vol.48 (1), p.128-134

2008

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Structure Elucidator: A Versatile Expert System for Molecular Structure Elucidation from 1D and 2D NMR Data and Molecular Fragments

Journal of Chemical Information and Computer Sciences, 2004-05, Vol.44 (3), p.771-792

2004

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HMBC-1,n-ADEQUATE spectra calculated from HMBC and 1,n-ADEQUATE spectra

Magnetic resonance in chemistry, 2013-05, Vol.51 (5), p.299-307

2013

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Enhanced automated structure elucidation by inclusion of two-bond specific data

Magnetic resonance in chemistry, 2010-08, Vol.48 (8), p.571-574

2010

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HSQC-ADEQUATE: an investigation of data requirements

Magnetic resonance in chemistry, 2011-06, Vol.49 (6), p.350-357

2011

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HSQC-1,1-ADEQUATE and HSQC-1,n-ADEQUATE: Enhanced Methods for Establishing Adjacent and Long-Range 13C–13C Connectivity Networks

Journal of natural products (Washington, D.C.), 2011-11, Vol.74 (11), p.2400-2407

2011

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Utilizing unsymmetrical indirect covariance processing to define 15N13C connectivity networks

Magnetic resonance in chemistry, 2007-08, Vol.45 (8), p.624-627

2007

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HMBC-1,1-ADEQUATE via generalized indirect covariance: a high sensitivity alternative to n,1-ADEQUATE

Magnetic resonance in chemistry, 2012-10, Vol.50 (10), p.691-695

2012

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Fuzzy Structure Generation: A New Efficient Tool for Computer-Aided Structure Elucidation (CASE)

Journal of chemical information and modeling, 2007-05, Vol.47 (3), p.1053-1066

2007

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Are Deterministic Expert Systems for Computer-Assisted Structure Elucidation Obsolete?

Journal of chemical information and modeling, 2006-07, Vol.46 (4), p.1643-1656

2006

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(13)C-(15)N correlation via unsymmetrical indirect covariance NMR: application to vinblastine

Journal of natural products (Washington, D.C.), 2007-12, Vol.70 (12), p.1966-1970

2007

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Using Unsymmetrical Indirect Covariance Processing to Calculate GHSQC-COSY Spectra

Journal of natural products (Washington, D.C.), 2007-09, Vol.70 (9), p.1393-1396

2007

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The use of unsymmetrical indirect covariance NMR methods to obtain the equivalent of HSQC-NOESY data

Magnetic resonance in chemistry, 2007-07, Vol.45 (7), p.544-546

2007

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Structure Elucidation from 2D NMR Spectra Using the StrucEluc Expert System: Detection and Removal of Contradictions in the Data

Journal of Chemical Information and Computer Sciences, 2004-09, Vol.44 (5), p.1737-1751

2004

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Long-range carbon-carbon connectivity via unsymmetrical indirect covariance processing of HSQC and HMBC NMR data

Magnetic resonance in chemistry, 2006-02, Vol.44 (2), p.107-109

2006

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Using indirect covariance spectra to identify artifact responses in unsymmetrical indirect covariance calculated spectra

Magnetic resonance in chemistry, 2008-02, Vol.46 (2), p.138-143

2008

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HSQC-1,n-ADEQUATE: a new approach to long-range 13C13C correlation by covariance processing

Magnetic resonance in chemistry, 2011-10, Vol.49 (10), p.641-647

2011

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Application of a New Expert System for the Structure Elucidation of Natural Products from Their 1D and 2D NMR Data

Journal of natural products (Washington, D.C.), 2002-05, Vol.65 (5), p.693-703

2002

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Multistep correlations via covariance processing of COSY/GCOSY spectra: opportunities and artifacts

Magnetic resonance in chemistry, 2008-11, Vol.46 (11), p.997-1002

2008

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The application of empirical methods of 13C NMR chemical shift prediction as a filter for determining possible relative stereochemistry

Magnetic resonance in chemistry, 2009-04, Vol.47 (4), p.333-341

2009

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Analysis and elimination of artifacts in indirect covariance NMR spectra via unsymmetrical processing

Magnetic resonance in chemistry, 2005-12, Vol.43 (12), p.999-1007

2005

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HSQC-ADEQUATE correlation: a new paradigm for establishing a molecular skeleton

Blind trials of computer-assisted structure elucidation software

Unequivocal determination of caulamidines A and B: application and validation of new tools in the structure elucidation tool box

Unequivocal structure confirmation of a breitfussin analog by anisotropic NMR measurements

Toward More Reliable 13C and 1H Chemical Shift Prediction: A Systematic Comparison of Neural-Network and Least-Squares Regression Based Approaches

Structure Elucidator: A Versatile Expert System for Molecular Structure Elucidation from 1D and 2D NMR Data and Molecular Fragments

HMBC-1,n-ADEQUATE spectra calculated from HMBC and 1,n-ADEQUATE spectra

Enhanced automated structure elucidation by inclusion of two-bond specific data

HSQC-ADEQUATE: an investigation of data requirements

HSQC-1,1-ADEQUATE and HSQC-1,n-ADEQUATE: Enhanced Methods for Establishing Adjacent and Long-Range 13C–13C Connectivity Networks

Utilizing unsymmetrical indirect covariance processing to define 15N13C connectivity networks

HMBC-1,1-ADEQUATE via generalized indirect covariance: a high sensitivity alternative to n,1-ADEQUATE

Fuzzy Structure Generation: A New Efficient Tool for Computer-Aided Structure Elucidation (CASE)

Are Deterministic Expert Systems for Computer-Assisted Structure Elucidation Obsolete?

(13)C-(15)N correlation via unsymmetrical indirect covariance NMR: application to vinblastine

Using Unsymmetrical Indirect Covariance Processing to Calculate GHSQC-COSY Spectra

The use of unsymmetrical indirect covariance NMR methods to obtain the equivalent of HSQC-NOESY data

Structure Elucidation from 2D NMR Spectra Using the StrucEluc Expert System: Detection and Removal of Contradictions in the Data

Long-range carbon-carbon connectivity via unsymmetrical indirect covariance processing of HSQC and HMBC NMR data

Using indirect covariance spectra to identify artifact responses in unsymmetrical indirect covariance calculated spectra

HSQC-1,n-ADEQUATE: a new approach to long-range 13C13C correlation by covariance processing

Application of a New Expert System for the Structure Elucidation of Natural Products from Their 1D and 2D NMR Data

Multistep correlations via covariance processing of COSY/GCOSY spectra: opportunities and artifacts

The application of empirical methods of 13C NMR chemical shift prediction as a filter for determining possible relative stereochemistry

Analysis and elimination of artifacts in indirect covariance NMR spectra via unsymmetrical processing

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