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51

Correlations of NBO energies of individual hydrogen bonds in nucleic acid base pairs with some QTAIM parameters

Szatylowicz, Halina, Jezierska, Aneta, Sadlej-Sosnowska, Nina

Journal:

Structural Chemistry

Year:

2016

Language:

english

File:

PDF, 1.08 MB

english, 2016

52

How Amino and Nitro Substituents Direct Electrophilic Aromatic Substitution in Benzene: Explanation with Kohn-Sham Molecular Orbital Theory and Voronoi Deformation Density Analysis

Stasyuk, Olga A., Szatylowicz, Halina, Krygowski, Tadeusz M, Fonseca Guerra, Célia

Journal:

Physical Chemistry Chemical Physics

Year:

2016

Language:

english

File:

PDF, 4.10 MB

english, 2016

53

Interactions of polar hydrogen bond donor solvents with ions: a theoretical study

Jaworski, Jan S., Bankiewicz, Barbara, Krygowski, T. Marek, Palusiak, Marcin, Stasyuk, Olga A., Szatylowicz, Halina

Journal:

Structural Chemistry

Year:

2016

Language:

english

File:

PDF, 1.39 MB

english, 2016

54

Assessment of soil texture class on agricultural fields using ECa, Amber NDVI, and topographic properties

Stępień, Michał, Samborski, Stanisław, Gozdowski, Dariusz, Dobers, Eike Stefan, Chormański, Jarosław, Szatyłowicz, Jan

Journal:

Journal of Plant Nutrition and Soil Science

Year:

2015

Language:

english

File:

PDF, 1.35 MB

english, 2015

55

ChemInform Abstract: Aromaticity from the Viewpoint of Molecular Geometry: Application to Planar Systems

Krygowski, Tadeusz M., Szatylowicz, Halina, Stasyuk, Olga A., Dominikowska, Justyna, Palusiak, Marcin

Journal:

Year:

2014

File:

PDF, 17 KB

2014

56

[Advances in Heterocyclic Chemistry] Heterocyclic Chemistry in the 21st Century - A Tribute to Alan Katritzky Volume 120 || Calculating the Aromaticity of Heterocycles

Szatylowicz, Halina

Year:

2016

Language:

english

File:

PDF, 1.49 MB

english, 2016

57

Validation of topsoil texture derived from agricultural soil maps by current dense soil sampling

Stępień, Michał, Gozdowski, Dariusz, Samborski, Stanisław, Dobers, Eike Stefan, Szatyłowicz, Jan, Chormański, Jarosław

Journal:

Journal of Plant Nutrition and Soil Science

Year:

2016

Language:

english

File:

PDF, 1.35 MB

english, 2016

58

Difference in pi-electron delocalization for monosubstituted olefinic and aromatic systems

Siodla, T., Szatylowicz, H., Varaksin, K. S., Krygowski, T. M.

Journal:

Year:

2016

Language:

english

File:

PDF, 460 KB

english, 2016

59

Classical and reverse substituent effects inmeta- andpara-substituted nitrobenzene derivatives

Szatylowicz, Halina, Jezuita, Anna, Ejsmont, Krzysztof, Krygowski, Tadeusz M.

Journal:

Structural Chemistry

Year:

2017

Language:

english

File:

PDF, 597 KB

english, 2017

60

Towards a physical interpretation of substituent effect: Quantum chemical interpretation of Hammett substituent constants

Varaksin, Konstantin S., Szatylowicz, Halina, Krygowski, Tadeusz M.

Journal:

Journal of Molecular Structure

Year:

2017

Language:

english

File:

PDF, 1.77 MB

english, 2017

61

Olefinic vs aromatic way of substituent effects: The case of 3- and 4-substituted cyclohexa-1,3-dienamine derivatives

Szatylowicz, Halina, Siodla, Tomasz, Krygowski, Tadeusz M.

Journal:

Journal of Physical Organic Chemistry

Year:

2017

Language:

english

File:

PDF, 833 KB

english, 2017

62

Towards physical interpretation of substituent effects: the case of N- and C3-substituted pyrrole derivatives

Zborowski, Krzysztof K., Szatylowicz, Halina, Stasyuk, Olga A., Krygowski, Tadeusz M.

Journal:

Structural Chemistry

Year:

2017

Language:

english

File:

PDF, 513 KB

english, 2017

63

The role of the long-range exchange corrections in the description of electron delocalization in aromatic species

Szczepanik, Dariusz W., Solà, Miquel, Andrzejak, Marcin, Pawełek, Barbara, Dominikowska, Justyna, Kukułka, Mercedes, Dyduch, Karol, Krygowski, Tadeusz M., Szatylowicz, Halina

Journal:

Journal of Computational Chemistry

Year:

2017

Language:

english

File:

PDF, 1.27 MB

english, 2017

64

Inductive or Field Substituent Effect? Quantum Chemical Modeling of Interactions in 1-Monosubstituted Bicyclooctane Derivatives

Szatylowicz, Halina, Siodła, Tomasz, Krygowski, Tadeusz M.

Journal:

Year:

2017

Language:

english

File:

PDF, 726 KB

english, 2017

65

Substituent Effect on the σ- and π-Electron Structure of the Nitro Group and the Ring in Meta - and Para -Substituted Nitrobenzenes

Szatylowicz, Halina, Jezuita, Anna, Ejsmont, Krzysztof, Krygowski, Tadeusz M.

Journal:

Journal of Physical Chemistry A

Year:

2017

Language:

english

File:

PDF, 1.16 MB

english, 2017

66

The electron density of delocalized bonds (EDDB) applied for quantifying aromaticity

Szczepanik, Dariusz Wojciech, Andrzejak, Marcin, Dominikowska, Justyna, Pawełek, Barbara, Krygowski, Tadeusz M, Szatylowicz, Halina, Solà, Miquel

Journal:

Physical Chemistry Chemical Physics

Year:

2017

Language:

english

File:

PDF, 1.23 MB

english, 2017

67

Toward the Physical Interpretation of Inductive and Resonance Substituent Effects and Reexamination Based on Quantum Chemical Modeling

Szatylowicz, Halina, Jezuita, Anna, Siodła, Tomasz, Varaksin, Konstantin S., Domanski, Mateusz A., Ejsmont, Krzysztof, Krygowski, Tadeusz M.

Journal:

Year:

2017

Language:

english

File:

PDF, 1.83 MB

english, 2017

68

Compatibility of methods used for soil water repellency determination for organic and organo-mineral soils

Papierowska, Ewa, Matysiak, Wojciech, Szatyłowicz, Jan, Debaene, Guillaume, Urbanek, Emilia, Kalisz, Barbara, Łachacz, Andrzej

Journal:

Year:

2018

Language:

english

File:

PDF, 548 KB

english, 2018

69

The Impact of Diesel Oil Pollution on the Hydrophobicity and CO2 Efflux of Forest Soils

Hewelke, Edyta, Szatyłowicz, Jan, Hewelke, Piotr, Gnatowski, Tomasz, Aghalarov, Rufat

Journal:

Water, Air & Soil Pollution

Year:

2018

Language:

english

File:

PDF, 1.35 MB

english, 2018

70

Aromaticity of acenes: the model of migrating π-circuits

Szczepanik, Dariusz, Solà, Miquel, Krygowski, Tadeusz M, Szatylowicz, Halina, Andrzejak, Marcin, Pawełek, Barbara, Dominikowska, Justyna, Kukułka, Mercedes, Dyduch, Karol

Journal:

Physical Chemistry Chemical Physics

Year:

2018

Language:

english

File:

PDF, 1.77 MB

english, 2018

71

Contact angle measurements and water drop behavior on leaf surface for several deciduous shrub and tree species from a temperate zone

Papierowska, Ewa, Szporak-Wasilewska, Sylwia, Szewińska, Joanna, Szatyłowicz, Jan, Debaene, Guillaume, Utratna, Marta

Journal:

Year:

2018

Language:

english

File:

PDF, 1.46 MB

english, 2018

72

Effect of Intra- and Intermolecular Interactions on the Properties of para-Substituted Nitrobenzene Derivatives

Szatylowicz, Halina, Stasyuk, Olga, Fonseca Guerra, Célia, Krygowski, Tadeusz

Journal:

Year:

2016

Language:

english

File:

PDF, 4.02 MB

english, 2016

73

Wetlands in flux: looking for the drivers in a central European case

Berezowski, Tomasz, Wassen, Martin, Szatyłowicz, Jan, Chormański, Jarosław, Ignar, Stefan, Batelaan, Okke, Okruszko, Tomasz

Journal:

Wetlands Ecology and Management

Year:

2018

Language:

english

File:

PDF, 3.70 MB

english, 2018

74

[AIP COMPUTATIONAL METHODS IN SCIENCE AND ENGINEERING: Theory and Computation: Old Problems and New Challenges. Lectures Presented at the International Conference on Computational Methods in Science and Engineering 2007 (ICCMSE 2007): VOLUME 1 - ()] AIP Conference Proceedings - Aromaticity—What Does It Mean?

Krygowski, Tadeusz M., Szatyłowicz, Halina, Simos, Theodore E., Maroulis, George

Year:

2007

Language:

english

File:

PDF, 720 KB

english, 2007

75

Stacking of nucleic acid bases: optimization of the computational approach—the case of adenine dimers

Marek, Paulina H., Szatylowicz, Halina, Krygowski, Tadeusz M.

Journal:

Structural Chemistry

Year:

2018

Language:

english

File:

PDF, 1.33 MB

english, 2018

76

Changes in Temperature and Moisture Content of an Extensive-Type Green Roof

Baryła, Anna, Gnatowski, Tomasz, Karczmarczyk, Agnieszka, Szatyłowicz, Jan

Journal:

Year:

2019

Language:

english

File:

PDF, 2.87 MB

english, 2019

77

Changes in Temperature and Moisture Content of an Extensive-Type Green Roof

Baryła, Anna, Gnatowski, Tomasz, Karczmarczyk, Agnieszka, Szatyłowicz, Jan

Journal:

Year:

2019

File:

PDF, 2.87 MB

2019

78

Experiments on Water Stabilization

Skoczko, Iwona, Szatyłowicz, Ewa

Journal:

Proceedings (American Bar Association. Section of International and Comparative Law)

Year:

2019

Language:

english

File:

PDF, 193 KB

english, 2019

79

Magnetic Field Usage for the Removal of Iron by Filtration-Assisted Different Filter Materials

Szatylowicz, Ewa, Skoczko, Iwona

Journal:

Proceedings (American Bar Association. Section of International and Comparative Law)

Year:

2019

Language:

english

File:

PDF, 196 KB

english, 2019

80

On the relations between aromaticity and substituent effect

Szatylowicz, Halina, Jezuita, Anna, Krygowski, Tadeusz M.

Journal:

Structural Chemistry

Year:

2019

Language:

english

File:

PDF, 2.13 MB

english, 2019

81

Aromaticity of the most stable adenine and purine tautomers in terms of Hückel's 4N+2 principle

Jezuita, Anna, Szatylowicz, Halina, Marek, Paulina H., Krygowski, Tadeusz M.

Journal:

Year:

2019

Language:

english

File:

PDF, 567 KB

english, 2019

82

Magnetic Field Usage Supported Filtration Through Different Filter Materials

Szatyłowicz, Ewa, Skoczko, Iwona

Journal:

Year:

2019

Language:

english

File:

PDF, 1002 KB

english, 2019

83

Influence of leaf surface wettability on the drop splash phenomenon

Papierowska, Ewa, Mazur, Rafał, Stańczyk, Tomasz, Beczek, Michał, Szewińska, Joanna, Sochan, Agata, Ryżak, Magdalena, Szatyłowicz, Jan, Bieganowski, Andrzej

Journal:

Agricultural and Forest Meteorology

Year:

2019

Language:

english

File:

PDF, 2.56 MB

english, 2019

84

Evaluation of the PAH Content in Soot from Solid Fuels Combustion in Low Power Boilers

Szatyłowicz, Ewa, Skoczko, Iwona

Journal:

Year:

2019

File:

PDF, 1.64 MB

2019

85

How amino and nitro substituents affect the aromaticity of benzene ring

Jezuita, Anna, Szatylowicz, Halina, Krygowski, Tadeusz M.

Journal:

Chemical Physics Letters

Year:

2020

File:

PDF, 518 KB

2020

86

Impact of the Substituents on the Electronic Structure of the Four Most Stable Tautomers of Purine and Their Adenine Analogues

Jezuita, Anna, Szatylowicz, Halina, Krygowski, Tadeusz M.

Journal:

Year:

2020

File:

PDF, 1.80 MB

2020

87

Substituted adenine quartets: interplay between substituent effect, hydrogen bonding, and aromaticity

Szatylowicz, Halina, Marek, Paulina H., Stasyuk, Olga A., Krygowski, Tadeusz M., SolÃ , Miquel

Journal:

Year:

2020

File:

PDF, 733 KB

2020

88

Effect of alkali metal cations on length and strength of hydrogen bonds in DNA base pairs

Stasyuk, Olga A., SolÃ , Miquel, Swart, Marcel, Fonseca Guerra, CÃ©lia, Krygowski, Tadeusz Marek, Szatylowicz, Halina

Journal:

Year:

2020

File:

PDF, 2.65 MB

2020

89

Mutual Relations between Substituent Effect, Hydrogen Bonding, and Aromaticity in Adenine-Uracil and Adenine-Adenine Base Pairs

Wieczorkiewicz, PaweÅ A., Szatylowicz, Halina, Krygowski, Tadeusz M.

Journal:

Year:

2020

File:

PDF, 4.25 MB

2020

90

Substituent effects of nitro group in cyclic compounds

Jezuita, Anna, Ejsmont, Krzysztof, Szatylowicz, Halina

Journal:

Structural Chemistry

Year:

2020

File:

PDF, 2.46 MB

2020