Semi-empirical Self-consistent Field Molecular Orbital Calculation of the Electronic Structure of the Base Pairs of Deoxyribonucleic Acid

Akira Imamura; Hiroko Fujita; Chikayoshi Nagata

doi:10.1246/bcsj.40.522

Semi-empirical Self-consistent Field Molecular Orbital Calculation of the Electronic Structure of the Base Pairs of Deoxyribonucleic Acid

Bulletin of the Chemical Society of Japan ◽

10.1246/bcsj.40.522 ◽

1967 ◽

Vol 40 (3) ◽

pp. 522-526 ◽

Cited By ~ 16

Author(s):

Akira Imamura ◽

Hiroko Fujita ◽

Chikayoshi Nagata

Keyword(s):

Electronic Structure ◽

Molecular Orbital ◽

Deoxyribonucleic Acid ◽

Molecular Orbital Calculation ◽

Base Pairs ◽

Consistent Field ◽

Self Consistent ◽

Self Consistent Field ◽

Semi Empirical

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Semi-empirical Self-consistent Field Molecular Orbital Calculation of the Electronic Structure of the Base Components of Nucleic Acids

Bulletin of the Chemical Society of Japan ◽

10.1246/bcsj.38.1638 ◽

1965 ◽

Vol 38 (10) ◽

pp. 1638-1645 ◽

Cited By ~ 42

Author(s):

Chikayoshi Nagata ◽

Akira Imamura ◽

Yusaku Tagashira ◽

Masahiko Kodama

Keyword(s):

Electronic Structure ◽

Nucleic Acids ◽

Molecular Orbital ◽

Molecular Orbital Calculation ◽

Consistent Field ◽

Self Consistent ◽

Self Consistent Field ◽

Semi Empirical

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Semi-empirical Self-consistent Field Molecular Orbital Calculation of Transition Energy and Oscillator Strength for the Stacked Complexes of Pyrene and 3,4-Benzopyrene with DNA Bases

Bulletin of the Chemical Society of Japan ◽

10.1246/bcsj.40.2564 ◽

1967 ◽

Vol 40 (11) ◽

pp. 2564-2568 ◽

Cited By ~ 6

Author(s):

Chikayoshi Nagata ◽

Hiroko Fujita ◽

Akira Imamura

Keyword(s):

Oscillator Strength ◽

Molecular Orbital ◽

Transition Energy ◽

Molecular Orbital Calculation ◽

Dna Bases ◽

Consistent Field ◽

Self Consistent ◽

Self Consistent Field ◽

Semi Empirical

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A semi-empirical self consistent field molecular orbital calculation on pyridine and pyridinium ion including all valence electrons

Journal of the Chemical Society A Inorganic Physical Theoretical ◽

10.1039/j19680001387 ◽

1968 ◽

pp. 1387 ◽

Cited By ~ 38

Author(s):

J. W. Emsley

Keyword(s):

Molecular Orbital ◽

Molecular Orbital Calculation ◽

Consistent Field ◽

Valence Electrons ◽

Self Consistent ◽

Self Consistent Field ◽

Semi Empirical ◽

Pyridinium Ion

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Semi-empirical Self-consistent Field Calculations of Heteroaromatic Compounds of Biological Interest. II. The π-Electronic Structure of Riboflavin

Chemical and Pharmaceutical Bulletin ◽

10.1248/cpb.18.157 ◽

1970 ◽

Vol 18 (1) ◽

pp. 157-163

Author(s):

MAMORU KAMIYA ◽

YUKIO AKAHORI

Keyword(s):

Electronic Structure ◽

Heteroaromatic Compounds ◽

Consistent Field ◽

Biological Interest ◽

Self Consistent ◽

Self Consistent Field ◽

Semi Empirical

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ChemInform Abstract: ELECTRONIC STRUCTURE OF PORPHYRINS, ALL VALENCE ELECTRON SELF-CONSISTENT FIELD MOLECULAR ORBITAL CALCULATIONS OF FREE BASE, MAGNESIUM, AND AQUOMAGNESIUM PORPHINES

Chemischer Informationsdienst ◽

10.1002/chin.197349086 ◽

1973 ◽

Vol 4 (49) ◽

pp. no-no

Author(s):

GERALD M. MAGGIORA

Keyword(s):

Electronic Structure ◽

Molecular Orbital ◽

Valence Electron ◽

Molecular Orbital Calculations ◽

Free Base ◽

Consistent Field ◽

Self Consistent ◽

Self Consistent Field

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Self-consistent Field Molecular Orbital Calculations on the Electronic Structure of Mono and Disubstituted Hydroxy (Methoxy) Benzenes.

Acta Chemica Scandinavica ◽

10.3891/acta.chem.scand.19-2027 ◽

1965 ◽

Vol 19 ◽

pp. 2027-2058 ◽

Cited By ~ 7

Author(s):

Sture Forsén ◽

Torbjörn Alm ◽

Costas Issidorides ◽

Anders Kallner

Keyword(s):

Electronic Structure ◽

Molecular Orbital ◽

Molecular Orbital Calculations ◽

Consistent Field ◽

Self Consistent ◽

Self Consistent Field

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Self-consistent field molecular orbital calculation for anthranil, benzisoxazole, and benzoxazole

Journal of Molecular Spectroscopy ◽

10.1016/0022-2852(69)90218-5 ◽

1969 ◽

Vol 32 (2) ◽

pp. 242-246 ◽

Cited By ~ 4

Author(s):

Susan D. Carson ◽

Herbert M. Rosenberg

Keyword(s):

Molecular Orbital ◽

Molecular Orbital Calculation ◽

Consistent Field ◽

Self Consistent ◽

Self Consistent Field

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Semi-empirical self-consistent-field molecular-orbital theory of molecules

Journal of Molecular Structure ◽

10.1016/0022-2860(72)85205-0 ◽

1972 ◽

Vol 14 (3) ◽

pp. 474-475

Author(s):

H. T

Keyword(s):

Molecular Orbital ◽

Molecular Orbital Theory ◽

Orbital Theory ◽

Consistent Field ◽

Self Consistent ◽

Self Consistent Field ◽

Semi Empirical

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Electronic structure of porphyrins. All valence electron self-consistent field molecular orbital calculations of free base, magnesium, and aquomagnesium porphines

Journal of the American Chemical Society ◽

10.1021/ja00801a005 ◽

1973 ◽

Vol 95 (20) ◽

pp. 6555-6559 ◽

Cited By ~ 53

Author(s):

Gerald M. Maggiora

Keyword(s):

Electronic Structure ◽

Molecular Orbital ◽

Valence Electron ◽

Molecular Orbital Calculations ◽

Free Base ◽

Consistent Field ◽

Self Consistent ◽

Self Consistent Field

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Ab initio self-consistent field molecular-orbital calculation of the ground state of tetranitratotitanium(IV); comments on the reactivity of anhydrous metal nitrates

Journal of the Chemical Society Dalton Transactions ◽

10.1039/dt9750001934 ◽

1975 ◽

pp. 1934 ◽

Cited By ~ 5

Author(s):

C. David Garner ◽

Ian H. Hillier ◽

Martyn F. Guest

Keyword(s):

Ab Initio ◽

Molecular Orbital ◽

Ground State ◽

Molecular Orbital Calculation ◽

Consistent Field ◽

Metal Nitrates ◽

Self Consistent ◽

Self Consistent Field

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