Books & Articles

226 entries « 4 of 16 »

2016

Šponer, Jiří, Shukla, Manoj K., Wang, Jing, Leszczynski, Jerzy

Computational Modeling of DNA and RNA Fragments (Incollection)

Handbook of Computational Chemistry, pp. 1–24, Springer Netherlands, Dordrecht, 2016.

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Sizochenko, Natalia, Majumdar, D., Roszak, Szczepan, Leszczynski, Jerzy

Application of Quantum Mechanics and Molecular Mechanics in Chemoinformatics (Incollection)

Handbook of Computational Chemistry, pp. 1–23, Springer Netherlands, Dordrecht, 2016.

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Tandabany C. Dinadayalane, Jerzy Leszczynski

Chapter: Hydrogenated Graphene: Preparation, Properties, and Applications (Incollection)

Aliofkhazraei, In; Ali,; Milne,; Ozkan,; Mitura,; Gervasoni, Juana (Ed.): Graphene Science Handbook: Fabrication Methods, pp. 431–450, CRC Press (Taylor & Francis Group), Boca Raton, 2016.

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Jiande Gu, Jing Wang, Jerzy Leszczynski

Electron interaction with a DNA duplex: dCpdC:dGpdG (Journal Article)

Phys. Chem. Chem. Phys., 18 (19), pp. 13657–13665, 2016, ISSN: 1463-9076.

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Natalia Sizochenko, Agnieszka Gajewicz, Jerzy Leszczynski, Tomasz Puzyn

Causation or only correlation? Application of causal inference graphs for evaluating causality in nano-QSAR models (Journal Article)

Nanoscale, 8 (13), pp. 7203–7208, 2016, ISSN: 2040-3364.

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Natalia Sizochenko, Jerzy Leszczynski

Review of Current and Emerging Approaches for Quantitative Nanostructure-Activity Relationship Modeling (Journal Article)

Journal of Nanotoxicology and Nanomedicine, 1 (1), pp. 1–16, 2016, ISSN: 2379-7452.

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Andrey A. Toropov, Alla P. Toropova, Karel Nesmerak, Aleksandar M. Veselinović, Jovana B. Veselinović, Danuta Leszczynska, Jerzy Leszczynski

Development of the Latest Tools for Building up “Nano-QSAR”: Quantitative Features—Property/Activity Relationships (QFPRs/QFARs) (Incollection)

Practical Aspects of Computational Chemistry IV, pp. 353–396, Springer US, Boston, MA, 2016.

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A.P. Toropova, A.A. Toropov, R. Rallo, D. Leszczynska, J., Leszczynski

Nano-QSAR: Genotoxicity of Multi-Walled Carbon Nanotubes (Journal Article)

Int. J. Environ. Res., 10 (1), pp. 59–64, 2016.

(Abstract | BibTeX | Tags: Bacterial reverse mutation test, CORAL software, MWCNT, Nano-QSAR)

Gulnara A. Yuldasheva, Georgii M. Zhidomirov, Jerzy Leszczynski, Aleksandr I. Ilin

Iodine Containing Drugs: Complexes of Molecular Iodine and Tri-iodide with Bioorganic Ligands and Lithium Halogenides in Aqueous Solutions (Incollection)

Practical Aspects of Computational Chemistry IV, pp. 279–301, Springer US, Boston, MA, 2016.

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Cui J Zhang G Liu Z Guan H Hwang H Aker W G Wang P Li Y.

Optimization study on the hydrogen peroxide pretreatment and production of bioethanol from seaweed Ulva prolifera biomass (Journal Article)

Bioresource Technology, 214 , pp. 144–149, 2016.

(Abstract | Links | BibTeX | Tags: Bio-ethanol production; Cellulosic material; Environment friendly; Optimization studies; Pre-Treatment; Pretreatment conditions; Pretreatment process; Ulva prolifera residue, Bioethanol; Energy resources; Ethanol; Hydrogen peroxide; Hydrolysis; Oxidation; Peroxides; Renewable energy resources; Seaweed; Yeast, Enzymatic hydrolysis, Saccharomyces cerevisiae; Ulva; Ulva prolifera)

Sanders S Aker W G Lin Y Douglas J Hwang H.-M. He X.

Assessing the effects of surface-bound humic acid on the phototoxicity of anatase and rutile TiO2 nanoparticles in vitro (Journal Article)

Journal of Environmental Sciences (China), 42 , pp. 50–60, 2016.

(Abstract | Links | BibTeX | Tags: Biological materials; Coatings; Energy gap; Escherichia coli; Irradiation; Nanoparticles; Organic acids; Oxide minerals; Oxygen; Surface treatment; Synthesis (chemical); Toxicity, Crystallinities; Humic acid; Initial concentration; Physicochemical property; Reactive oxygen species; Simulated sunlight; Surface coatings; TiO, Escherichia coli, Titanium dioxide)

Hwang H.-M. He X.

Nanotechnology in food science: Functionality, applicability, and safety assessment (Journal Article)

Journal of Food and Drug Analysis, 2016.

(Abstract | Links | BibTeX | Tags: food industry; investment; market; nanotechnology; nutritional science; physical chemistry; risk assessment)

McAlliser D Aker W G Hwang H.-M. He X.

Assessing the effect of different natural dissolved organic matters on the cytotoxicity of titanium dioxide nanoparticles with bacteria (Journal Article)

Journal of Environmental Sciences (China), 2016.

(Abstract | Links | BibTeX | Tags: Bacteria; Biogeochemistry; Biological materials; Cytotoxicity; Escherichia coli; Flavonoids; High resolution transmission electron microscopy; Nanoparticles; Organic acids; Organic compounds; Oxides; Tannins; Titanium; Transmission electron microscopy, Dissolved organic matters; Humic acid; Manufactured nanomaterials; Natural environments; Reactive oxygen species; Scientific community; Tannic acid; Titanium dioxide nanoparticles, Titanium dioxide)

2015

Natalia Sizochenko, Victor Kuz’min, Liudmila Ognichenko, Jerzy Leszczynski

Introduction of simplex-informational descriptors for QSPR analysis of fullerene derivatives (Journal Article)

Journal of Mathematical Chemistry, 2015, ISSN: 0259-9791.

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Natalia Sizochenko, Karolina Jagiello, Jerzy Leszczynski, Tomasz Puzyn

How the “Liquid Drop” Approach Could Be Efficiently Applied for Quantitative Structure–Property Relationship Modeling of Nanofluids (Journal Article)

The Journal of Physical Chemistry C, 119 (45), pp. 25542–25547, 2015, ISSN: 1932-7447.

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226 entries « 4 of 16 »