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Clustering of Red/White Wine and Allergen/Non-Allergen Data Sets by Using Descriptor Fingerprints

IOP conference series. Materials Science and Engineering, 2021-01, Vol.1031 (1), p.12053

2021

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Chromatographic Retention Modeling of Alkylazoles by QSRR Approach

Acta Scientifica Naturalis, 2018-12, Vol.5 (2), p.77-89

2018

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Descriptor Fingerprints and Their Application to WhiteWine Clustering and Discrimination

Acta Scientifica Naturalis, 2018-03, Vol.5 (1), p.24-34

2018

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Computer-assisted structure generation from a gross formula. 5. Toward the solution of the isomorphism problem in generation of chemical graphs: generation of benzenoid hydrocarbons

Journal of chemical information and computer sciences, 1992-03, Vol.32 (2), p.167-173

Bangov, I. P

1992

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Computer-assisted structure generation from a gross formula. 3. Alleviation of the combinatorial problem

Journal of chemical information and computer sciences, 1990-08, Vol.30 (3), p.277-289

Bangov, I. P

1990

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Fast calculation of π-electron charge densities in organic molecules: Non-condensed compounds

Analytica chimica acta, 1995-10, Vol.314 (1), p.101-110

1995

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CTI : a novel charge-related topological index with low degeneracy

Journal of mathematical chemistry, 1991-12, Vol.8 (4), p.367-382

1991

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Use of the super(13)C-NMR chemical shift/charge density linear relationship for recognition and ranking of chemical structures

Analytica chimica acta, 1988-01, Vol.209, p.29-43

Bangov, I P

1988

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Generation of molecular graphs based on flexible utilization of the available structural information

Discrete Applied Mathematics, 1996-05, Vol.67 (1), p.27-49

Bangov, Ivan P.

1996

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Employment of fuzzy information derived from spectroscopic data toward reducing the redundancy in the process of structure generation

Journal of chemical information and computer sciences, 1994-01, Vol.34 (1), p.171-178

1994

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Use of the 13C-NMR chemical shift/charge density linear relationship for recognition and ranking of chemical structures

Analytica chimica acta, 1988, Vol.209 (1-2), p.29-43

Bangov, Ivan P.

1988

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NMR and theoretical conformational investigations of some 3-substituted propionitriles

Journal of molecular structure, 1980-01, Vol.65, p.189-198

1980

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ChemInform Abstract: Fuzzy Logic in Computer-Aided Structure Elucidation

ChemInform, 1997-09, Vol.28 (37), p.no-no

BANGOV, I. P.

1997

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Computer-assisted structure generation from a gross formula: II. Multiple bond unsaturated and cyclic compounds. Employment of fragments

Journal of mathematical chemistry, 1988-02, Vol.2 (1), p.31-48

1988

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Structure generation from a gross formula. 7. Graph isomorphism: a consequence of the vertex distance

Journal of chemical information and computer sciences, 1994-03, Vol.34 (2), p.318-324

Bangov, I P

1994

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Structure generation from a gross formula. VII: Graph isomorphism: a consequence of the vertex equivalence

Journal of chemical information and computer sciences, 1994, Vol.34 (2), p.318-324

BANGOV, I. P

1994

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ChemInform Abstract: Computer-Assisted Structure Generation from a Gross Formula. Part 5. Toward the Solution of the Isomorphism Problem in Generation of Chemical Graphs: Generation of Benzenoid Hydrocarbons

ChemInform, 1992-07, Vol.23 (28), p.no-no

BANGOV, I. P.

1992

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Toward the solution of the isomorphism problem in generation of chemical graphs : generation of benzenoid hydrocarbons

Journal of chemical information and computer sciences, 1992, Vol.32 (2), p.167-173

BANGOV, I. P

1992

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Automatic Assignment of 13 C NMR Signals: IV. 13 C Chemical Shift/Charge Density Linear Relationship Re-investigated

Zeitschrift für physikalische Chemie (Neue Folge), 1987-01, Vol.268O (1), p.891-898

1987

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Computer-assisted structure generation from a gross formula. III, Alleviation of the combinatorial problem

Journal of chemical information and computer sciences, 1990, Vol.30 (3), p.277-289

BANGOV, I. P

1990

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Computer-assisted structure generation from a gross formula. 6. Reducing the structure redundancy by the employment of 2D NMR spectral information

Journal of chemical information and computer sciences, 1994-05, Vol.34 (3), p.546-557

1994

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Structure Generation from a Gross Formula. 7. Graph Isomorphism: A Consequence of the Vertex Equivalence

Journal of chemical information and computer sciences, 1994-03, Vol.34 (2), p.318-324

Bangov, Ivan P

1994

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Equation for the energy of alternant molecular orbitals for alternant molecules with heteroatoms

Theoretical and experimental chemistry, 1976-11, Vol.10 (6), p.655-658

1976

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ChemInform Abstract: Automatic Assignment of 13C NMR Signals. Part 4. 13C Chemical Shift/Charge Density Linear Relationship Reinvestigated

ChemInform, 1988-02, Vol.19 (5), p.no-no

1988

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ChemInform Abstract: UNTERSUCHUNG DER ELEKTRONENSTRUKTUR DER RADIALENE MIT DER METHODE DER ALTERNIERENDEN MOLEKUELORBITALE

Chemischer Informationsdienst, 1974-07, Vol.5 (27)

1974

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Clustering of Red/White Wine and Allergen/Non-Allergen Data Sets by Using Descriptor Fingerprints

Chromatographic Retention Modeling of Alkylazoles by QSRR Approach

Descriptor Fingerprints and Their Application to WhiteWine Clustering and Discrimination

Computer-assisted structure generation from a gross formula. 5. Toward the solution of the isomorphism problem in generation of chemical graphs: generation of benzenoid hydrocarbons

Computer-assisted structure generation from a gross formula. 3. Alleviation of the combinatorial problem

Fast calculation of π-electron charge densities in organic molecules: Non-condensed compounds

CTI : a novel charge-related topological index with low degeneracy

Use of the super(13)C-NMR chemical shift/charge density linear relationship for recognition and ranking of chemical structures

Generation of molecular graphs based on flexible utilization of the available structural information

Employment of fuzzy information derived from spectroscopic data toward reducing the redundancy in the process of structure generation

Use of the 13C-NMR chemical shift/charge density linear relationship for recognition and ranking of chemical structures

NMR and theoretical conformational investigations of some 3-substituted propionitriles

ChemInform Abstract: Fuzzy Logic in Computer-Aided Structure Elucidation

Computer-assisted structure generation from a gross formula: II. Multiple bond unsaturated and cyclic compounds. Employment of fragments

Structure generation from a gross formula. 7. Graph isomorphism: a consequence of the vertex distance

Structure generation from a gross formula. VII: Graph isomorphism: a consequence of the vertex equivalence

ChemInform Abstract: Computer-Assisted Structure Generation from a Gross Formula. Part 5. Toward the Solution of the Isomorphism Problem in Generation of Chemical Graphs: Generation of Benzenoid Hydrocarbons

Toward the solution of the isomorphism problem in generation of chemical graphs : generation of benzenoid hydrocarbons

Automatic Assignment of 13 C NMR Signals: IV. 13 C Chemical Shift/Charge Density Linear Relationship Re-investigated

Computer-assisted structure generation from a gross formula. III, Alleviation of the combinatorial problem

Computer-assisted structure generation from a gross formula. 6. Reducing the structure redundancy by the employment of 2D NMR spectral information

Structure Generation from a Gross Formula. 7. Graph Isomorphism: A Consequence of the Vertex Equivalence

Equation for the energy of alternant molecular orbitals for alternant molecules with heteroatoms

ChemInform Abstract: Automatic Assignment of 13C NMR Signals. Part 4. 13C Chemical Shift/Charge Density Linear Relationship Reinvestigated

ChemInform Abstract: UNTERSUCHUNG DER ELEKTRONENSTRUKTUR DER RADIALENE MIT DER METHODE DER ALTERNIERENDEN MOLEKUELORBITALE

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