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Publication Cover
Journal of Environmental Science and Health, Part B
Pesticides, Food Contaminants, and Agricultural Wastes
Volume 49, 2014 - Issue 6
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ARTICLES

QSPR prediction of chromatographic retention times of pesticides: Partition and fractal indices

Francisco TorrensInstitut Universitari de Ciència Molecular, Universitat de València, Edifici d’Instituts de Paterna, València, SpainCorrespondence[email protected] [email protected]
&
Gloria CastellanoFacultad de Veterinaria y Ciencias Experimentales, Universidad Católica de Valencia San Vicente Mártir, València, Spain
Pages 400-407 | Received 13 Nov 2013, Published online: 24 Apr 2014

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Mostafa Sadeghi, Esmat Mohammadinasab & Tahereh Momeni Isfahani. (2023) QSPR models for predicting the Kovats retention indices of synthetic ester derivatives based on pyrethrin essential oil. Journal of Essential Oil Research 35:6, pages 542-562.
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Pooja Sharma, Prabhat Ranjan & Tanmoy Chakraborty. Applications of conceptual density functional theory in reference to quantitative structure–activity / property relationship. Molecular Physics 0:0.
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Articles from other publishers (9)

Cristian Rojas, José F. Aranda, Elisa Pacheco Jaramillo, Irene Losilla, Piercosimo Tripaldi, Pablo R. Duchowicz & Eduardo A. Castro. (2021) Foodinformatic prediction of the retention time of pesticide residues detected in fruits and vegetables using UHPLC/ESI Q-Orbitrap. Food Chemistry 342, pages 128354.
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Francisco Torrens & Gloria Castellano. 2019. The Dual Nature of Caffeine and Caffeine Related Drugs [Working Title]. The Dual Nature of Caffeine and Caffeine Related Drugs [Working Title].
Francisco Torrens & Gloria Castellano. (2018) QSPR Prediction of Retention Times of Methylxanthines and Cotinine by Bioplastic Evolution. International Journal of Quantitative Structure-Property Relationships 3:1, pages 74-87.
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Francisco Torrens & Gloria Castellano. 2017. Quantitative Structure-activity Relationship. Quantitative Structure-activity Relationship.
Alla P. Toropova & Andrey A. Toropov. (2017) Hybrid optimal descriptors as a tool to predict skin sensitization in accordance to OECD principles. Toxicology Letters 275, pages 57-66.
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Alla P. Toropova, Andrey A. Toropov, Aleksandar M. Veselinović, Jovana B. Veselinović, Danuta Leszczynska & Jerzy Leszczynski. (2016) Monte Carlo–based quantitative structure–activity relationship models for toxicity of organic chemicals to Daphnia magna . Environmental Toxicology and Chemistry 35:11, pages 2691-2697.
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Gloria Castellano & Francisco Torrens. (2015) Quantitative Structure-Antioxidant Activity Models of Isoflavonoids: A Theoretical Study. International Journal of Molecular Sciences 16:12, pages 12891-12906.
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Andrey A. Toropov & Alla P. Toropova. (2015) Quasi-QSAR for mutagenic potential of multi-walled carbon-nanotubes. Chemosphere 124, pages 40-46.
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Francisco Torrens & Gloria Castellano. (2014) Molecular Classification of Pesticides Including Persistent Organic Pollutants, Phenylurea and Sulphonylurea Herbicides. Molecules 19:6, pages 7388-7414.
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