Antimicrobial Properties of 4-Aryl-3-(2-methyl-furan-3-yl)-Δ2-1,2,4-triazoline-5-thiones

Authors: Agata Siweka, Monika Wujeca, Joanna Stefanacuteskab, and Piotr Panethc
Publication year: 2010
Journal / Book title: Phosphorus, Sulfur, and Silicon and the Related Elements

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Linear free energy relationships of half-wave reduction potentials of (E)-4-aryl-4-oxo-2-butenoic acids

Authors: Ferenc T. Pastora and Branko J. Drakulić
Publication year: 2010
Journal / Book title: Tetrahedron Letters

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Calculation of quantum-mechanical Descriptors for QSPR at the DFT level: Is it necessary?

Author(s): Puzyn T (Puzyn, Tomasz), Suzuki N (Suzuki, Noriyuki), Haranczyk M (Haranczyk, Maciej), Rak J (Rak, Janusz)
Publication year: 2008
Journal / Book title: JOURNAL OF CHEMICAL INFORMATION AND MODELING

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  ...

Linear free energy relationship based estimates for the congener specific relative reductive defluorination rates of perfluorinated alkyl compounds

Author(s): Rayne S (Rayne, Sierra), Forest K (Forest, Kaya), Friesen KJ (Friesen, Ken J.)
Publication year: 2009
JOURNAL OF ENVIRONMENTAL SCIENCE AND HEALTH PART A-TOXIC/HAZARDOUS SUBSTANCES & ENVIRONMENTAL ENGINEERING

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A tentative quantitative structure–toxicity relationship study of benzodiazepine drugs

Authors: Simona Funar-Timofei, Daniela Ionescu, Takahiro Suzuki
Publication year: 2010
Journal / Book title: Toxicology in Vitro

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Reliability of bond dissociation enthalpy calculated by the PM6 method and experimental TEAC values in antiradical QSAR of flavonoids

Authors: Dragan Amića and Bono Lučić
Publication year: 2010
Journal / Book title: Bioorganic & Medicinal Chemistry

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How the energy evaluation method used in the geometry optimization step affect the quality of the subsequent QSAR/QSPR models

Author(s): Asmund Rinnan, Niels Johan Christensen and Søren Balling Engelsen
Publication year: 2010
Journal / Book title: JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN

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2D and 3D QSAR Studies of the Receptor Binding Affinity of Progestins

Authors: Lea da Silva Veras, Masamoto Arakawa, Kimito Funatsu, and Yuji Takahata
Publication year: 2010
Journal / Book title: JOURNAL OF THE BRAZILIAN CHEMICAL SOCIETY

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Recent Advances in QSAR Studies: Methods and Applications (Challenges and Advances in Computational Chemistry and Physics)

Tomasz Puzyn, University of Gdańsk, Gdańsk, Poland.
Jerzy Leszczynski, Jackson State University, Jackson, MS, USA.
Mark T. Cronin, Liverpool John Moores University, Liverpool, UK.

ISBN-10: 1402097824
ISBN-13: 978-1402097829

Publisher: Springer
Copyright: 2009
Format: Cloth; 414 pp
Published: 04/12/2009

RM1 is featured in Section 2.4 entitled: Semi-Empirical Methods: AM1 and RM1.

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Antiplatelet activity and structure-activity relationship study of Pyrazolopyridine derivatives as potential series for treating thrombotic diseases

Authors: RB Geraldo, ML Bello, LRS Dias, MAF Vera, T Nagashima, PA Abreu, MB Santos, MG Albuquerque, LM Cabral, ACC Freitas, MV Kalil, CR Rodrigues, and HC Castro
Publication year: 2010
Journal / Book title: Journal of Atherosclerosis and Thrombosis

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