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51

Efficient method for the generation and display of electrostatic potential surfaces from ab-initio wavefunctions

W.Andrzej Sokalski, Scott F. Sneddon

Journal:

Journal of Molecular Graphics

Year:

1991

Language:

english

File:

PDF, 573 KB

english, 1991

52

Usefulness of one electron properties in the study of the nitromethane-to-methyl nitrite rearrangement

S. Roszak, A.H. Lowrey, W.A. Sokalski, Joyce J. Kaufmanf

Journal:

Journal of Molecular Graphics

Year:

1994

Language:

english

File:

PDF, 695 KB

english, 1994

53

The physical nature of catalytic activity due to the molecular environment in terms of intermolecular interaction theory: derivation of simplified models

W.Andrzej Sokalski

Journal:

Journal of Molecular Catalysis

Year:

1985

Language:

english

File:

PDF, 1.02 MB

english, 1985

54

Isotopy shift's analysis of the normal frequencies of crystal lattice

Journal:

Physics Letters A

Year:

1976

Language:

english

File:

PDF, 201 KB

english, 1976

55

Spin configurations near singularities in micromagnetism

Journal:

Physics Letters A

Year:

1980

Language:

english

File:

PDF, 116 KB

english, 1980

56

Dynamical Stability of instantons

Journal:

Physics Letters A

Year:

1981

Language:

english

File:

PDF, 144 KB

english, 1981

57

A theory for nematic liquid crystals

Th.W. Ruijgrok, K. Sokalski

Journal:

Physica A: Statistical Mechanics and its Applications

Year:

1982

Language:

english

File:

PDF, 976 KB

english, 1982

58

Bond-moving transformations for continuous-spin systems

K. Sokalski, Th.W. Ruijgrok

Journal:

Physica A: Statistical Mechanics and its Applications

Year:

1985

Language:

english

File:

PDF, 1.09 MB

english, 1985

59

Analysis of the Migdal transformation for models with planar spins on a two-dimensional lattice

K. Sokalski, Th.W. Ruijgrok, B. Schoenmaker

Journal:

Physica A: Statistical Mechanics and its Applications

Year:

1987

Language:

english

File:

PDF, 1.41 MB

english, 1987

60

A theory of monolayer phase transitions

Th.W. Ruijgrok, K. Sokalski

Journal:

Physica A: Statistical Mechanics and its Applications

Year:

1988

Language:

english

File:

PDF, 464 KB

english, 1988

61

Sudden changes in the spectrum of a quantum system

Th.W. Ruijgrok, K. Sokalski

Journal:

Physica A: Statistical Mechanics and its Applications

Year:

1993

Language:

english

File:

PDF, 1.06 MB

english, 1993

62

An almost integrable quantum system in 1 + ε dimensions

Th.W. Ruijgrok, K. Sokalski

Journal:

Physica A: Statistical Mechanics and its Applications

Year:

1994

Language:

english

File:

PDF, 529 KB

english, 1994

63

Quantum chemical studies on molecular mechanism of mutations: II. Double proton transfer in formic acid dimer

W.Andrzej Sokalski, Hubert Romanowski, Andrzej Jaworski

Journal:

Advances in Molecular Relaxation and Interaction Processes

Year:

1977

Language:

english

File:

PDF, 550 KB

english, 1977

64

Propagation of τ-neutrinos and τ-leptons through the Earth and their detection in underwater/ice neutrino telescopes

Edgar Bugaev, Teresa Montaruli, Yuri Shlepin, Igor Sokalski

Journal:

Astroparticle Physics

Year:

2004

Language:

english

File:

PDF, 891 KB

english, 2004

65

Effect of neutral current interactions on high energy muon and electron neutrino propagation through the earth

Annalisa L’Abbate, Teresa Montaruli, Igor Sokalski

Journal:

Astroparticle Physics

Year:

2005

Language:

english

File:

PDF, 347 KB

english, 2005

66

Attractive halogen–halogen interactions: F3CCl⋯FH and F3CCl⋯FCH3 dimers

Sławomir J. Grabowski, Andrzej J. Sadlej, W. Andrzej Sokalski, Jerzy Leszczynski

Journal:

Chemical Physics

Year:

2006

Language:

english

File:

PDF, 195 KB

english, 2006

67

Wide spectrum of H⋯H interactions: van der Waals contacts, dihydrogen bonds and covalency

Sławomir J. Grabowski, W. Andrzej Sokalski, Jerzy Leszczynski

Journal:

Chemical Physics

Year:

2007

Language:

english

File:

PDF, 706 KB

english, 2007

68

Interaction energies in stacked DNA bases? How important are electrostatics?

Glake Hill, Gareth Forde, Nicholas Hill, William A. Lester Jr., W. Andrzej Sokalski, Jerzy Leszczynski

Journal:

Chemical Physics Letters

Year:

2003

Language:

english

File:

PDF, 154 KB

english, 2003

69

Hydride bonding – Ab initio studies of BeH2…Li+, BeH2…Na+ and BeH2…Mg2+ model systems

Sławomir J. Grabowski, W. Andrzej Sokalski, Jerzy Leszczynski

Journal:

Chemical Physics Letters

Year:

2006

Language:

english

File:

PDF, 206 KB

english, 2006

70

Can H…σ, π…H+…σ and σ…H+…σ interactions be classified as H-bonded?

Sławomir J. Grabowski, W. Andrzej Sokalski, Jerzy Leszczynski

Journal:

Chemical Physics Letters

Year:

2006

Language:

english

File:

PDF, 336 KB

english, 2006

71

Plus–minus algorithm — A method for derivation of the Bäcklund transformations

T. Wietecha, K. Sokalski

Journal:

Journal of Symbolic Computation

Year:

2009

Language:

english

File:

PDF, 867 KB

english, 2009

72

Calcium ion-selective electrodes under galvanostatic current control

Iwona Bedlechowicz, Tomasz Sokalski, Andrzej Lewenstam, Magdalena Maj-zurawska

Journal:

Sensors and Actuators B: Chemical

Year:

2005

Language:

english

File:

PDF, 152 KB

english, 2005

73

Physical nature of catalytic effects of Si→Al substitutions in ZMS-5 zeolite for propylene protonation reaction

P Dziekoński, W.A Sokalski, B Szyja, J Leszczynski

Journal:

Chemical Physics Letters

Year:

2002

Language:

english

File:

PDF, 462 KB

english, 2002

74

Nonempirical analysis of the catalytic activity of the molecular environment – optimal static and dynamic catalytic fields for double proton transfer in formamide–formamidine complex

Pawel Dziekonski, W.Andrzej Sokalski, Yevgeniy Podolyan, Jerzy Leszczynski

Journal:

Chemical Physics Letters

Year:

2003

Language:

english

File:

PDF, 162 KB

english, 2003

75

Electrostatic nature of catalytic effects resulting from Si>Al substitutions in ZMS-5 zeolite

P. Dziekoński, W.A. Sokalski, E. Kassab, M. Allavena

Journal:

Chemical Physics Letters

Year:

1998

Language:

english

File:

PDF, 353 KB

english, 1998

76

Non-empirical analysis of the nature of the inhibitor–active-site interactions in leucine aminopeptidase

J. Grembecka, P. Kȩdzierski, W.A. Sokalski

Journal:

Chemical Physics Letters

Year:

1999

Language:

english

File:

PDF, 348 KB

english, 1999

77

Influence of key parameters on the lower detection limit and response function of solvent polymeric membrane ion-selective electrodes

Alan Ceresa, Tomasz Sokalski, Ernö Pretsch

Journal:

Journal of Electroanalytical Chemistry

Year:

2001

Language:

english

File:

PDF, 194 KB

english, 2001

78

Effect of a plasticizer on the detection limit of calcium-selective electrodes

Iwona Bedlechowicz, Magdalena Maj-Żurawska, Tomasz Sokalski, Adam Hulanicki

Journal:

Journal of Electroanalytical Chemistry

Year:

2002

Language:

english

File:

PDF, 173 KB

english, 2002

79

Preface

W. Andrzej Sokalski, Morris Krauss

Journal:

Computers & Chemistry

Year:

2000

Language:

english

File:

PDF, 45 KB

english, 2000

80

Finite element distributions in statistical theory of energy levels in quantum systems

Maciej M. Duras, Krzysztof Sokalski

Journal:

Physica D: Nonlinear Phenomena

Year:

1999

Language:

english

File:

PDF, 163 KB

english, 1999

81

Physical nature of environmental effects on intermolecular proton transfer in (O2NOH⋯NH3)(H2O)n and (ClH⋯NH3)(H2O)n (n=1–3) complexes

Pawel Dziekonski, W.Andrzej Sokalski, Jerzy Leszczynski

Journal:

Chemical Physics

Year:

2001

Language:

english

File:

PDF, 468 KB

english, 2001

82

Concept order parameter for random matrix ensemble

Krzysztof Sokalski

Journal:

Physics Letters A

Year:

1997

Language:

english

File:

PDF, 294 KB

english, 1997

83

Sequence-selectivity of 5,11-dimethyl-5H-indolo[2,3-b]quinoline binding to DNA. Footprinting and molecular modeling studies

Jarosław Osiadacz, Jerzy Majka, Kamil Czarnecki, Wanda Peczyńska-Czoch, Jolanta Zakrzewska-Czerwińska, Łukasz Kaczmarek, W.Andrzej Sokalski

Journal:

Bioorganic & Medicinal Chemistry

Year:

2000

Language:

english

File:

PDF, 1.20 MB

english, 2000

84

Synthesis, and cytotoxic activity of some novel indolo[2,3-b]quinoline derivatives: DNA topoisomerase II inhibitors

L̵ukasz Kaczmarek, Wanda Peczyńska-Czoch, Jarosław Osiadacz, Marian Mordarski, W.Andrzej Sokalski, Janusz Boratyński, Ewa Marcinkowska, Halina Glazman-Kuśnierczyk, Czesław Radzikowski

Journal:

Bioorganic & Medicinal Chemistry

Year:

1999

Language:

english

File:

PDF, 287 KB

english, 1999

85

Different types of hydrogen bonds: correlation analysis of interaction energy components

Slawomir J. Grabowski, W. Andrzej Sokalski

Journal:

Journal of Physical Organic Chemistry

Year:

2005

Language:

english

File:

PDF, 370 KB

english, 2005

86

Low frequency vibrations in lepidocrocite (α-FeOOH) studied by infrared absorption

A. Mazurkiewicz, K. Sokalski, A. Szytuła

Journal:

physica status solidi (a)

Year:

1973

Language:

english

File:

PDF, 134 KB

english, 1973

87

Linear ising chain in the molecular field

Journal:

physica status solidi (b)

Year:

1979

Language:

english

File:

PDF, 146 KB

english, 1979

88

Phase Transition in a Magnet with Surface by Means of the BPW Method

K. Sokalski, W. Wòjcik

Journal:

physica status solidi (b)

Year:

1980

Language:

english

File:

PDF, 179 KB

english, 1980

89

The Grand-Canonical Ensemble Description of a Diluted Ising Ferromagnet. Critical Temperature Dependence on the Value of the Chemical Potential

K. Sokalski, W. Wójcik

Journal:

physica status solidi (b)

Year:

1980

Language:

english

File:

PDF, 209 KB

english, 1980

90

Pure Site Percolation Problem for Linear Ising Chain in the Molecular Field

W. Wójcik, K. Sokalski

Journal:

physica status solidi (b)

Year:

1981

Language:

english

File:

PDF, 142 KB

english, 1981

91

A Simple Model of Thin Magnetic Films

K. Sokalski, W. Wójcik

Journal:

physica status solidi (b)

Year:

1983

Language:

english

File:

PDF, 119 KB

english, 1983

92

Critical Temperature of a Quasi-One-Dimensional Ising Model

K. Sokalski, W. Wójcik

Journal:

physica status solidi (b)

Year:

1983

Language:

english

File:

PDF, 261 KB

english, 1983

93

The Ising model of the two-dimensional quasiperiodic lattice

A. Doroba, K. Sokalski

Journal:

physica status solidi (b)

Year:

1989

Language:

english

File:

PDF, 627 KB

english, 1989

94

The Time-Dependent Ising Model on the 2D Penrose Lattice

A. Doroba, K. Sokalski

Journal:

physica status solidi (b)

Year:

1991

Language:

english

File:

PDF, 604 KB

english, 1991

95

Electrostatic models of inhibitory activity

J. Grembecka, P. Kȩdzierski, W. A. Sokalski, J. Leszczyński

Journal:

International Journal of Quantum Chemistry

Year:

2001

Language:

english

File:

PDF, 256 KB

english, 2001

96

Quantum chemical analysis of the interactions of transition state analogs with leucine aminopeptidase

J. Grembecka, W. A. Sokalski, P. Kafarski

Journal:

International Journal of Quantum Chemistry

Year:

2001

Language:

english

File:

PDF, 145 KB

english, 2001

97

Quantum chemical analysis of reaction paths in chorismate mutase: Conformational effects and electrostatic stabilization

Borys Szefczyk, Frederik Claeyssens, Adrian J. Mulholland, W. Andrzej Sokalski

Journal:

International Journal of Quantum Chemistry

Year:

2007

Language:

english

File:

PDF, 554 KB

english, 2007

98

Approximate exchange perturbation study of intermolecular interactions in molecular complexes

W. Andrzej Sokalski, Henryk Chojnacki

Journal:

International Journal of Quantum Chemistry

Year:

1978

Language:

english

File:

PDF, 647 KB

english, 1978

99

Theoretical studies on substrate binding to the active site of carbonic anhydrase

Andrzej Sawaryn, W. Andrzej Sokalski

Journal:

International Journal of Quantum Chemistry

Year:

1979

Language:

english

File:

PDF, 299 KB

english, 1979

100

Explanation of the artifact structure predictions within the semiempirical ZDO SCF supermolecular approach

W. A. Sokalski, P. C. Hariharan, Herbert E. Popkie, Joyce J. Kaufman

Journal:

International Journal of Quantum Chemistry

Year:

1980

Language:

english

File:

PDF, 131 KB

english, 1980