Combining DFT and QSAR studies for predicting psychotomimetic activity of substituted phenethylamines using statistical methodsFootnote
Peer review under responsibility of Taibah University

A. AouidateMolecular Chemistry and Natural Substances Laboratory, Faculty of Science, Moulay Ismail University, Meknes, Morocco

A. GhalebMolecular Chemistry and Natural Substances Laboratory, Faculty of Science, Moulay Ismail University, Meknes, Morocco

M. GhamaliMolecular Chemistry and Natural Substances Laboratory, Faculty of Science, Moulay Ismail University, Meknes, Morocco

S. ChtitaMolecular Chemistry and Natural Substances Laboratory, Faculty of Science, Moulay Ismail University, Meknes, Morocco

M. ChoukradMolecular Chemistry and Natural Substances Laboratory, Faculty of Science, Moulay Ismail University, Meknes, Morocco

A. SbaiMolecular Chemistry and Natural Substances Laboratory, Faculty of Science, Moulay Ismail University, Meknes, Morocco

M. BouachrineESTM, Moulay Ismail University, Meknes, Morocco

T. LakhlifiMolecular Chemistry and Natural Substances Laboratory, Faculty of Science, Moulay Ismail University, Meknes, Morocco

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Lívia Salviano Mariotto, Caio Henrique Pinke Rodrigues & Aline Thais Bruni. (2024) Does Conformation Affect the Analytical Response? A Structural and Infrared Spectral Evaluation of Phenethylamines (2C-H, 25H-NBOH, and 25I-NBOMe) Using In Silico Methodology. Psychoactives 3:1, pages 78-92.
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Steluța Gosav, Mirela Praisler, Nicoleta Păduraru Cristea, Teodora Gosav & Cristina Paraschiv. (2024) Experimental and computational studies of 3-(N-morpholinylcarbodithioate)-2-(4-methoxyphenyl)chroman-4-one, a flavanone with potential therapeutical properties. Journal of Molecular Structure 1295, pages 136627.
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Taiwo W. Quadri, Lukman O. Olasunkanmi, Omolola E. Fayemi, Hassane Lgaz, Omar Dagdag, El-Sayed M. Sherif, Awad A. Alrashdi, Ekemini D. Akpan, Han-Seung Lee & Eno E. Ebenso. (2022) Computational insights into quinoxaline-based corrosion inhibitors of steel in HCl: Quantum chemical analysis and QSPR-ANN studies. Arabian Journal of Chemistry 15:7, pages 103870.
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Elaheh Izadpanah, Siavash Riahi, Zeinab Abbasi-Radmoghaddam, Sajjad Gharaghani & Mohammad Mohammadi-Khanaposhtanai. (2021) A simple and robust model to predict the inhibitory activity of α-glucosidase inhibitors through combined QSAR modeling and molecular docking techniques. Molecular Diversity 25:3, pages 1811-1825.
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Mohammad Hossein Keshavarz, Zeinab Shirazi & Mohammad Ali Rezayat. (2021) A simple method for assessing the psychotomimetic activity of the substituted phenethylamines. Zeitschrift für anorganische und allgemeine Chemie 647:6, pages 651-662.
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Milena Jadrijević-Mladar Takač, Joao Daniel Casimiro Magina & Tin Takač. (2019) Evaluation of phenylethylamine type entactogens and their metabolites relevant to ecotoxicology – a QSAR study. Acta Pharmaceutica 69:4, pages 563-584.
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Mahboob Alam, Mohammad Jane Alam, Shaista Azaz, Mehtab Parveen, Soonheum Park & Shabbir Ahmad. (2018) DFT/TD-DFT calculations, spectroscopic characterizations (FTIR, NMR, UV–vis), molecular docking and enzyme inhibition study of 7-benzoyloxycoumarin. Computational Biology and Chemistry 73, pages 65-78.
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Combining DFT and QSAR studies for predicting psychotomimetic activity of substituted phenethylamines using statistical methodsFootnote
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Combining DFT and QSAR studies for predicting psychotomimetic activity of substituted phenethylamines using statistical methodsFootnotePeer review under responsibility of Taibah University

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Combining DFT and QSAR studies for predicting psychotomimetic activity of substituted phenethylamines using statistical methodsFootnote
Peer review under responsibility of Taibah University