Corongiu, A: search on Z-Library

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51

HF–CC model for atoms and molecules

E. Clementi, G. Corongiu

Journal:

International Journal of Quantum Chemistry

Year:

2002

Language:

english

File:

PDF, 244 KB

english, 2002

52

Gas-phase geometries and energies of bis(2,2′-bipyridine) interacting either with Cu(I) or Ag(I): Computational study

Giorgina Corongiu, Paola Nava

Journal:

International Journal of Quantum Chemistry

Year:

2003

Language:

english

File:

PDF, 167 KB

english, 2003

53

Comments on computational chemistry: From diatomic molecules to large biochemical systems

Enrico Clementi, Giorgina Corongiu

Journal:

International Journal of Quantum Chemistry

Year:

2005

Language:

english

File:

PDF, 552 KB

english, 2005

54

HF–HL method: Combination of Hartree–Fock and Heitler–London approximations

Giorgina Corongiu

Journal:

International Journal of Quantum Chemistry

Year:

2005

Language:

english

File:

PDF, 181 KB

english, 2005

55

From atomic and molecular orbitals to chemical orbitals

Enrico Clementi, Giorgina Corongiu

Journal:

International Journal of Quantum Chemistry

Year:

2008

Language:

english

File:

PDF, 292 KB

english, 2008

56

Energy and density analysis on the H2 molecule from the united atom to dissociation: The Σ, Π, Δ, ϕ, and Γ manifolds

Giorgina Corongiu, Enrico Clementi

Journal:

International Journal of Quantum Chemistry

Year:

2011

Language:

english

File:

PDF, 4.91 MB

english, 2011

57

Interaction of water with DNA single and double helix in the B conformation

E. Clementi, G. Corongiu

Journal:

International Journal of Quantum Chemistry

Year:

1979

Language:

english

File:

PDF, 987 KB

english, 1979

58

Theoretical study of some Van der Waals molecules

W. Kołos, G. Corongiu, E. Clementi

Journal:

International Journal of Quantum Chemistry

Year:

1980

Language:

english

File:

PDF, 1.15 MB

english, 1980

59

B-DNA structural determination of Na+ counterions at different humidities, ionic concentrations, and temperatures

E. Clementi, G. Corongiu

Journal:

International Journal of Quantum Chemistry

Year:

1982

Language:

english

File:

PDF, 1.66 MB

english, 1982

60

Charge transfer in nucleic acids

Enrico Clement, Giorgina Corongiu

Journal:

International Journal of Quantum Chemistry

Year:

1982

Language:

english

File:

PDF, 501 KB

english, 1982

61

The solvent effect in enzyme—substrate interactions: Models of carboxypeptidase

Carol A. Venanzi, Harel Weinstein, Georgina Corongiu, Enrico Clementi

Journal:

International Journal of Quantum Chemistry

Year:

1982

Language:

english

File:

PDF, 530 KB

english, 1982

62

Theoretical and computational chemistry of complex systems: Solvation of DNA and proteins

E. Clementi, G. Corongiu, M. Gratarola, P. Habitz, C. Lupo, P. Otto, D. Vercauteren

Journal:

International Journal of Quantum Chemistry

Year:

1982

Language:

english

File:

PDF, 1.59 MB

english, 1982

63

Monte carlo study of liquid water with two- and three-body ab initio potentials

E. Clementi, G. Corongiu

Journal:

International Journal of Quantum Chemistry

Year:

1983

Language:

english

File:

PDF, 530 KB

english, 1983

64

Hydration of agarose double helix: A monte carlo simulation

Giorgina Corongiu, Sandro L. Fornili, Enrico Clementi

Journal:

International Journal of Quantum Chemistry

Year:

1983

Language:

english

File:

PDF, 721 KB

english, 1983

65

Parallelism in quantum chemistry: Hydrogen bond study in DNA base pairs as an example

E. Clementi, G. Corongiu, J. Detrich, S. Chin, L. Domingo

Journal:

International Journal of Quantum Chemistry

Year:

1984

Language:

english

File:

PDF, 1.02 MB

english, 1984

66

Monte Carlo liquid water simulations with four-body interactions included

J. Detrich G. Corongiu, E. Clementi

Journal:

International Journal of Quantum Chemistry

Year:

1984

Language:

english

File:

PDF, 411 KB

english, 1984

67

Supercomputing and supercomputers for science and engineering in general and for chemistry and biosciences in particular

E. Clementi, S. Chin, G. Corongiu, J. H. Detrich, M. Dupuis, D. Folsom, G. C. Lie, D. Logan, V. Sonnad

Journal:

International Journal of Quantum Chemistry

Year:

1989

Language:

english

File:

PDF, 5.61 MB

english, 1989

68

Preliminary observations on a new water–water potential

U. Niesar, G. Corongiu, M.-J. Huang, M. Dupuis, E. Clementi

Journal:

International Journal of Quantum Chemistry

Year:

1989

Language:

english

File:

PDF, 933 KB

english, 1989

69

Molecular dynamics simulation for liquid water using a polarizable and flexible potential

Giorgina Corongiu

Journal:

International Journal of Quantum Chemistry

Year:

1992

Language:

english

File:

PDF, 1.19 MB

english, 1992

70

Comments on the carbon cluster C60 and on its complexes with alkaline elements

G. Corongiu, E. Clementi

Journal:

International Journal of Quantum Chemistry

Year:

1992

Language:

english

File:

PDF, 1.27 MB

english, 1992

71

Ab initio force field for simulations of proteins and nucleic acids

Misako Aida, Giorgina Corongiu, Enrico Clementi

Journal:

International Journal of Quantum Chemistry

Year:

1992

Language:

english

File:

PDF, 1.17 MB

english, 1992

72

Time scales and other problems in linking simulations of simple chemical systems to more complex ones

Enrico Clementi, Giorgina Corongiu, Dario Estrin, Eduardo Hollauer, Omar G. Stradella

Journal:

International Journal of Quantum Chemistry

Year:

1993

Language:

english

File:

PDF, 2.09 MB

english, 1993

73

Solvent effects in density functional calculations of uracil and cytosine tautomerism

Luca Paglieri, Giorgina Corongiu, Darío A. Estrin

Journal:

International Journal of Quantum Chemistry

Year:

1995

Language:

english

File:

PDF, 704 KB

english, 1995

74

The hydration shell of myoglobin

F. Parak, H. Hartmann, M. Schmidt, G. Corongiu, E. Clementi

Journal:

European Biophysics Journal

Year:

1992

Language:

english

File:

PDF, 884 KB

english, 1992

75

Muscarine and water: Ab initio potentials

C. Margheritis, G. Corongiu

Journal:

Structural Chemistry

Year:

1990

Language:

english

File:

PDF, 543 KB

english, 1990

76

Structure of aggregates of water and Li+, Na+, or K+counterions with nucleic acid in solution

Enrico Clementi, Giorgina Corongiu

Journal:

Journal of Biological Physics

Year:

1983

Language:

english

File:

PDF, 2.04 MB

english, 1983

77

Merging two traditional methods: the Hartree–Fock and the Heitler–London and adding density functional correlation corrections

Enrico Clementi, Giorgina Corongiu

Journal:

Theoretical Chemistry Accounts: Theory, Computation, and Modeling (Theoretica Chimica Acta)

Year:

2007

Language:

english

File:

PDF, 938 KB

english, 2007

78

A novel Cx32 mutation causes X-linked Charcot-Marie-Tooth disease with brainstem involvement and brain magnetic resonance spectroscopy abnormalities

M. R. Murru, A. Vannelli, G. Marrosu, E. Cocco, D. Corongiu, S. Tranquilli, M. V. Cherchi, M. Mura, L. Barberini, G. Mallarini, M. G. Marrosu

Journal:

Neurological Sciences

Year:

2006

Language:

english

File:

PDF, 102 KB

english, 2006

79

Peroxidase-catalyzed oxidation of β-carotene in HL-60 cells and in model systems: Involvement of phenoxyl radicals

Vladimir A. Tyurin, Gianfranca Carta, Yulia Y. Tyurina, Sebastiano Banni, Billy W. Day, Francesco P. Corongiu, Valerian E. Kagan

Journal:

Year:

1997

Language:

english

File:

PDF, 581 KB

english, 1997

80

Recognition and quantitation ofcis-vaccenic and eicosenoic fatty acids in olive oils by13C nuclear magnetic resonance spectroscopy

P. Scano, M. Casu, A. Lai, G. Saba, M. A. Dessi, M. Deiana, F. P. Corongiu, G. Bandino

Journal:

Year:

1999

Language:

english

File:

PDF, 63 KB

english, 1999

81

Conjugated linoleic acid and oxidative stress

Sebastiano Banni, Elisabetta Angioni, Maria Stefania Contini, Gianfranca Carta, Viviana Casu, Giorgio Amedeo Iengo, Maria Paola Melis, Monica Deiana, Maria Assunta Dessì, Francesco P. Corongiu

Journal:

Journal of the American Oil Chemists' Society

Year:

1998

Language:

english

File:

PDF, 193 KB

english, 1998

82

Symmetry-adapted perturbation theory calculations of uracil—water interaction energy

Stanislaw Ryback, Krzysztof Szalewicz, Bogumil Jeziorski, Gina Corongiu

Journal:

Chemical Physics Letters

Year:

1992

Language:

english

File:

PDF, 653 KB

english, 1992

83

The Parkes Multibeam Pulsar Survey – VI. Discovery and timing of 142 pulsars and a Galactic population analysis

D. R. Lorimer, A. J. Faulkner, A. G. Lyne, R. N. Manchester, M. Kramer, M. A. McLaughlin, G. Hobbs, A. Possenti, I. H. Stairs, F. Camilo, M. Burgay, N. D'Amico, A. Corongiu, F. Crawford

Journal:

Monthly Notices of the Royal Astronomical Society

Year:

2006

Language:

english

File:

PDF, 2.41 MB

english, 2006

84

Purification, primary structure, and properties ofEuphorbia characiaslatex purple acid phosphatase

F. Pintus, D. Spano, S. Corongiu, G. Floris, R. Medda

Journal:

Biochemistry (Moscow)

Year:

2011

Language:

english

File:

PDF, 396 KB

english, 2011

85

Molecular dynamics simulations of liquid water using the NCC ab initio potential

Niesar, U., Corongiu, G., Clementi, E., Kneller, G. R., Bhattacharya, D. K.

Journal:

Journal of Physical Chemistry

Year:

1990

Language:

english

File:

PDF, 841 KB

english, 1990

86

Small Clusters of Water Molecules Using Density Functional Theory

Estrin, D. A., Paglieri, L., Corongiu, G., Clementi, E.

Journal:

Journal of Physical Chemistry

Year:

1996

Language:

english

File:

PDF, 282 KB

english, 1996

87

Nonorthogonal orbitals; the Hartree–Fock–Heitler–London method and preliminary applications

Enrico Clementi, Giorgina Corongiu

Journal:

International Journal of Quantum Chemistry

Year:

2012

Language:

english

File:

PDF, 2.41 MB

english, 2012

88

Prevention by cystamine of the rat liver polysomal disaggregation induced by carbon tetrachloride (CCl4)

F. P. Corongiu, S. Dessi, A. Sanna, L. Congiu

Journal:

Cellular and Molecular Life Sciences

Year:

1974

Language:

english

File:

PDF, 210 KB

english, 1974

89

Failure of carbon tetrachloride (CCl4) and trichlorobromo-methane (CCl3Br) to alter polyribosomal profiles in the rat brain

F. P. Corongiu, S. Dessi, A. Sanna, L. Congiu

Journal:

Cellular and Molecular Life Sciences

Year:

1973

Language:

english

File:

PDF, 243 KB

english, 1973

90

An improved and simple method for determining diene conjugation in autoxidized polyunsaturated fatty acids

Francesco P. Corongiu, Anna Milia

Journal:

Chemico-Biological Interactions

Year:

1983

Language:

english

File:

PDF, 400 KB

english, 1983

91

NMR spin-lattice relaxation times of intracellular Na-23 on rat livers and related lipid peroxidation following CCl4 intoxication

Sebastiano Banni, Mariano Casu, Francesco P. Corongiu, Maria A. Dessi, Adolfo Lai, Cristina Meloni

Journal:

Chemico-Biological Interactions

Year:

1987

Language:

english

File:

PDF, 428 KB

english, 1987

92

Improved ab initio pair potentials for the interaction between nucleic acid bases and water

K. Sagarik, G. Corongiu, E. Clementi

Journal:

Journal of Molecular Structure: THEOCHEM

Year:

1991

Language:

english

File:

PDF, 2.30 MB

english, 1991

93

Conjugated dienes detected in tissue lipid extracts by second derivative spectrophotometry

F.P. Corongiu, S. Banni, M.A. Dessi

Journal:

Free Radical Biology and Medicine

Year:

1989

Language:

english

File:

PDF, 323 KB

english, 1989

94

Detection of conjugated dienes of different source in rat's tissue lipids

Sebastiano Banni, Francesco P. Corongiu, Maria A. Dessi, Benito Lombardi, Maria G. Salgo

Journal:

Free Radical Biology and Medicine

Year:

1990

Language:

english

File:

PDF, 119 KB

english, 1990

95

Free radicals and antioxidants in nutrition, volume VII: 437 pp., 1993

F. Corongiu, S. Banni, M. Dessi, C. Rice-Evans, W.A. Pryor

Journal:

Free Radical Biology and Medicine

Year:

1994

Language:

english

File:

PDF, 61 KB

english, 1994

96

Lipid peroxidation and molecular damage to polyunsaturated fatty acids in rat liver. Recognition of two classes of hydroperoxides formed under conditions in vivo

Francesco P. Corongiu, Giuseppe Poli, Mario U. Dianzani, Kevin H. Cheeseman, Trevor F. Slater

Journal:

Chemico-Biological Interactions

Year:

1986

Language:

english

File:

PDF, 566 KB

english, 1986

97

Study of the electronic structure of molecules. XXIII. Decomposition of correlation energy into atomic, covalent, ionic and van der Waals components

E. Clementi, G. Corongiu

Journal:

Journal of Molecular Structure: THEOCHEM

Year:

2001

Language:

english

File:

PDF, 213 KB

english, 2001

98

Revision and extension of the HF-CC method

E Clementi, G Corongiu

Journal:

Journal of Molecular Structure: THEOCHEM

Year:

1999

Language:

english

File:

PDF, 359 KB

english, 1999

99

Inhibition of peroxynitrite dependent DNA base modification and tyrosine nitration by the extra virgin olive oil-derived antioxidant hydroxytyrosol

Monica Deiana, Okezie I Aruoma, Maria de Lourdes P Bianchi, Jeremy P.E Spencer, Harparkash Kaur, Barry Halliwell, Robert Aeschbach, Sebastiano Banni, M.Assunta Dessi, Francesco P Corongiu

Journal:

Free Radical Biology and Medicine

Year:

1999

Language:

english

File:

PDF, 241 KB

english, 1999

100

Enhanced Interfacial Catalysis and Hydrolytic Specificity of Phospholipase A2 toward Peroxidized Phosphatidylcholine Vesicles

M.G. Salgo, F.P. Corongiu, A. Sevanian

Journal:

Archives of Biochemistry and Biophysics

Year:

1993

File:

PDF, 1017 KB

1993