Publications by authors named "Simona Funar-Timofei"

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Experimental and Computational Study of Novel Pyrazole Azo Dyes as Colored Materials for Light Color Paints.
Sabina Nitu, Marius Silviu Milea, Sorina Boran, Giannin Mosoarca, Alina D Zamfir, Simona Funar-Timofei

Materials (Basel)· August 2022

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Homology Modeling and Molecular Docking Approaches for the Proposal of Novel Insecticides against the African Malaria Mosquito ().
Luminita Crisan, Simona Funar-Timofei, Ana Borota

Molecules· June 2022

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Application of Molecular Docking, Homology Modeling, and Chemometric Approaches to Neonicotinoid Toxicity against Aphis craccivora.
Luminita Crisan, Ana Borota, Alina Bora, Takahiro Suzuki, Simona Funar-Timofei

Mol Inform· March 2022

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An Approach to Identify New Insecticides Against Myzus Persicae. In silico Study Based on Linear and Non-linear Regression Techniques.
Luminita Crisan, Ana Borota, Takahiro Suzuki, Simona Funar-Timofei

Mol Inform· August 2019

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Neonicotinoid insecticide design: molecular docking, multiple chemometric approaches, and toxicity relationship with Cowpea aphids.
Alina Bora, Takahiro Suzuki, Simona Funar-Timofei

Environ Sci Pollut Res Int· May 2019

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Combined molecular docking and QSAR study of fused heterocyclic herbicide inhibitors of D1 protein in photosystem II of plants.
Simona Funar-Timofei, Ana Borota, Luminita Crisan

Mol Divers· May 2017

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Quantitative estimation of pesticide-likeness for agrochemical discovery.
Sorin Avram, Simona Funar-Timofei, Ana Borota, Sridhar Rao Chennamaneni, Anil Kumar Manchala

J Cheminform· December 2014

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The Hydractinia echinata test-system. III: Structure-toxicity relationship study of some azo-, azo-anilide, and diazonium salt derivatives.
Sergiu Adrian Chicu, Melania Munteanu, Ioana Cîtu, Codruta Soica, Cristina Dehelean, Simona Funar-Timofei

Molecules· July 2014

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Modeling of 2-pyridin-3-yl-benzo[d][1,3]oxazin-4-one derivatives by several conformational searching tools and molecular docking.
Mohammad Goodarzi, Alina Bora, Ana Borota, Simona Funar-Timofei, Sorin Avram

Curr Pharm Des· September 2013

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Hydractinia echinata test system. II. SAR toxicity study of some anilide derivatives of Naphthol-AS type.
Sergiu Adrian Chicu, Simona Funar-Timofei, Georgeta-Maria Simu

Chemosphere· March 2011

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A tentative quantitative structure-toxicity relationship study of benzodiazepine drugs.
Simona Funar-Timofei, Daniela Ionescu, Takahiro Suzuki

Toxicol In Vitro· February 2010

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Multilinear regression and comparative molecular field analysis (CoMFA) of azo dye-fiber affinities. 2. Inclusion of solution-phase molecular orbital descriptors.
Gerrit Schüürmann, Simona Funar-Timofei

J Chem Inf Comput Sci· July 2004

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Quantitative structure-activity relationships for the enantioselectivity of oxirane ring-opening catalyzed by epoxide hydrolases.
Simona Funar-Timofei, Takahiro Suzuki, Joachim A Paier, Andreas Steinreiber, Kurt Faber

J Chem Inf Comput Sci· October 2003

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Comparative molecular field analysis (CoMFA) of anionic azo dye-fiber affinities I: gas-phase molecular orbital descriptors.
Simona Funar-Timofei, Gerrit Schüürmann

J Chem Inf Comput Sci· September 2002

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