Citations (35)
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Carolina L. Bellera, Mauricio E. Di Ianni & Alan Talevi. (2018) The application of molecular topology for ulcerative colitis drug discovery. Expert Opinion on Drug Discovery 13:1, pages 89-101.
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H. Golmohammadi & Z. Dashtbozorgi. (2016) QSPR studies for predicting polarity parameter of organic compounds in methanol using support vector machine and enhanced replacement method. SAR and QSAR in Environmental Research 27:12, pages 977-997.
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Eslam Pourbasheer, Reza Aalizadeh, Mohammad Reza Ganjali & Parviz Norouzi. (2015) Prediction of Superoxide Quenching Activity of Fullerene (C60) Derivatives by Genetic Algorithm-Support Vector Machine. Fullerenes, Nanotubes and Carbon Nanostructures 23:4, pages 290-299.
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Mehdi Nekoei, Nasser Goudarzi, Saeeid Nekoei & Majid Mohammadhosseini. (2014) QSAR Study of Arylsulfonylpiperazine Inhibitors of 11β-HSD1 by GA-MLR, GA-PLS and GA-ANN. Analytical Chemistry Letters 4:1, pages 14-28.
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Articles from other publishers (31)
Zeinab Heidari & Mohammad Amin Sobati. (2023) Evaluation of the flammability characteristics of alkyl esters: New QSPR models. Journal of Molecular Liquids 387, pages 122697.
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Zeinab Heidari & Mohammad Amin Sobati. (2023) New structure-based models for the prediction of flash point and autoignition temperatures of alkyl esters. Chemometrics and Intelligent Laboratory Systems, pages 104877.
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Mohamed El fadili, Mohammed Er-rajy, Hamada Imtara, Omar M. Noman, Ramzi A. Mothana, Sheaf Abdullah, Sara Zerougui & Menana Elhallaoui. (2023) QSAR, ADME-Tox, molecular docking and molecular dynamics simulations of novel selective glycine transporter type 1 inhibitors with memory enhancing properties. Heliyon 9:2, pages e13706.
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Małgorzata Janicka, Anna Śliwińska, Małgorzata Sztanke & Krzysztof Sztanke. (2022) Combined Micellar Liquid Chromatography Technique and QSARs Modeling in Predicting the Blood–Brain Barrier Permeation of Heterocyclic Drug-like Compounds. International Journal of Molecular Sciences 23:24, pages 15887.
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Matan Birenboim, Elazar Fallik, David Kengisbuch & Jakob A. Shimshoni. (2022) Quantitative and qualitative spectroscopic parameters determination of major cannabinoids. Journal of Luminescence 252, pages 119387.
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Tengyi Zhu, Cuicui Tao, Haomiao Cheng & Haibing Cong. (2022) Versatile in silico modelling of microplastics adsorption capacity in aqueous environment based on molecular descriptor and machine learning. Science of The Total Environment 846, pages 157455.
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Cosmin Trif, Dragos Paul Mihai, Anca Zanfirescu & George Mihai Nitulescu. (2022) Structural Model Based on Genetic Algorithm for Inhibiting Fatty Acid Amide Hydrolase. AI 3:4, pages 863-870.
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Mohamed El fadili, Mohammed Er-Rajy, Mohammed Kara, Amine Assouguem, Assia Belhassan, Amal Alotaibi, Nidal Naceiri Mrabti, Hafize Fidan, Riaz Ullah, Sezai Ercisli, Sara Zarougui & Menana Elhallaoui. (2022) QSAR, ADMET In Silico Pharmacokinetics, Molecular Docking and Molecular Dynamics Studies of Novel Bicyclo (Aryl Methyl) Benzamides as Potent GlyT1 Inhibitors for the Treatment of Schizophrenia. Pharmaceuticals 15:6, pages 670.
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Tengyi Zhu, Wenxuan Chen, Yuanyuan Gu, Chad T Jafvert & Dafang Fu. (2021) Polyethylene-water partition coefficients for polychlorinated biphenyls: Application of QSPR predictions models with experimental validation. Water Research 207, pages 117799.
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Liming Gu, Tengyi Zhu & Ming Chen. (2021) Modeling polyurethane foam (PUF)-air partition coefficients for persistent organic pollutants using linear and non-linear chemometric methods. Journal of Environmental Chemical Engineering 9:4, pages 105615.
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Tengyi Zhu, Liming Gu, Ming Chen & Feng Sun. (2021) Exploring QSPR models for predicting PUF-air partition coefficients of organic compounds with linear and nonlinear approaches. Chemosphere 266, pages 128962.
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Mozhgan Beglari, Nasser Goudarzi, Davood Shahsavani, Mansour Arab Chamjangali & Rahele Dousti. (2020) QSAR modeling of anti-HIV activity for DAPY-like derivatives using the mixture of ligand-receptor binding information and functional group features as a new class of descriptors. Network Modeling Analysis in Health Informatics and Bioinformatics 9:1.
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Nafiseh Vahedi, Majid Mohammadhosseini & Mehdi Nekoei. (2020) QSAR Study of PARP Inhibitors by GA-MLR, GA-SVM and GA-ANN Approaches. Current Analytical Chemistry 16:8, pages 1088-1105.
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Materu Yuyama, Takeshi Ito, Yumiko Arai, Yuki Kadowaki, Natsumi Iiyama, Ayako Keino, Yurina Hiraoka, Takayuki Kanaya, Yasuyuki Momose & Masaaki Kurihara. (2020) Risk Prediction Method for Anticholinergic Action Using Auto-quantitative Structure–Activity Relationship and Docking Study with Molecular Operating Environment. Chemical and Pharmaceutical Bulletin 68:8, pages 773-778.
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Tengyi Zhu, Yuanyuan Gu, Haomiao Cheng & Ming Chen. (2020) Versatile modelling of polyoxymethylene-water partition coefficients for hydrophobic organic contaminants using linear and nonlinear approaches. Science of The Total Environment 728, pages 138881.
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Rhoda Oyeladun Oyewole, Abel Kolawole Oyebamiji & Banjo Semire. (2020) Theoretical calculations of molecular descriptors for anticancer activities of 1, 2, 3-triazole-pyrimidine derivatives against gastric cancer cell line (MGC-803): DFT, QSAR and docking approaches. Heliyon 6:5, pages e03926.
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Mabrouk Hamadache, Othmane Benkortbi, Salah Hanini & Abdeltif Amrane. (2017) QSAR modeling in ecotoxicological risk assessment: application to the prediction of acute contact toxicity of pesticides on bees (Apis mellifera L.). Environmental Science and Pollution Research 25:1, pages 896-907.
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Hassan Golmohammadi, Zahra Dashtbozorgi & Sajad Khooshechin. (2017) Modeling and predicting the solute polarity parameter in reversed-phase liquid chromatography using quantitative structure-property relationship approaches. Journal of Separation Science 40:23, pages 4495-4502.
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Zahra Dashtbozorgi, Hassan Golmohammadi & Sajad Khooshechin. (2017) QSPR models for prediction of bovine serum albumin-water partition coefficients of organic compounds and drugs based on enhanced replacement method and support vector machine. Computational Toxicology 4, pages 1-10.
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F. Abrigach, Y. Karzazi, R. Benabbes, M. El Youbi, M. Khoutoul, N. Taibi, N. Karzazi, N. Benchat, M. Bouakka, E. Saalaoui & R. Touzani. (2017) Synthesis, biological screening, POM, and 3D-QSAR analyses of some novel pyrazolic compounds. Medicinal Chemistry Research 26:8, pages 1784-1795.
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Milica Ž. Karadžić, Lidija R. Jevrić, Anamarija I. Mandić, Siniša L. Markov, Sanja O. Podunavac-Kuzmanović, Strahinja Z. Kovačević, Andrea R. Nikolić, Aleksandar M. Oklješa, Marija N. Sakač & Katarina M. Penov-Gaši. (2017) Chemometrics approach based on chromatographic behavior, in silico characterization and molecular docking study of steroid analogs with biomedical importance. European Journal of Pharmaceutical Sciences 105, pages 71-81.
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Abolghasem Beheshti, Eslam Pourbasheer, Mehdi Nekoei & Saadat Vahdani. (2016) QSAR modeling of antimalarial activity of urea derivatives using genetic algorithm–multiple linear regressions. Journal of Saudi Chemical Society 20:3, pages 282-290.
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Reza Aalizadeh, Eslam Pourbasheer & Mohammad Reza Ganjali. (2015) Analysis of B-Raf $$^{\mathrm{V600E}}$$ V 600 E inhibitors using 2D and 3D-QSAR, molecular docking and pharmacophore studies. Molecular Diversity 19:4, pages 915-930.
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Mehdi Nekoei, Majid Mohammadhosseini & Eslam Pourbasheer. (2015) QSAR study of VEGFR-2 inhibitors by using genetic algorithm-multiple linear regressions (GA-MLR) and genetic algorithm-support vector machine (GA-SVM): a comparative approach. Medicinal Chemistry Research 24:7, pages 3037-3046.
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Eslam Pourbasheer, Reza Aalizadeh, Jamal Saffar Ardabili & Mohammad Reza Ganjali. (2015) QSPR study on solubility of some fullerenes derivatives using the genetic algorithms — Multiple linear regression. Journal of Molecular Liquids 204, pages 162-169.
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Maryam Hamzeh-Mivehroud, Babak Sokouti & Siavoush Dastmalchi. 2015. Quantitative Structure-Activity Relationships in Drug Design, Predictive Toxicology, and Risk Assessment. Quantitative Structure-Activity Relationships in Drug Design, Predictive Toxicology, and Risk Assessment
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Javad Shadmanesh, Aiyoub Parchehbaf Jadid, Zhila Azari, Mehri Niazi & Mahdi Shahmohammadi Aghbolagh. (2013) QSAR study of active human glucagon receptor antagonists by SW-MLR and SW-SVM methods. Medicinal Chemistry Research 23:5, pages 2639-2650.
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Eslam Pourbasheer, Abolghasem Beheshti, Habibollah Khajehsharifi, Mohammad Reza Ganjali & Parviz Norouzi. (2012) QSAR study on hERG inhibitory effect of kappa opioid receptor antagonists by linear and non-linear methods. Medicinal Chemistry Research 22:9, pages 4047-4058.
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