Publications

Yassir Boulaamane, Iman Touati, Nainee Goyal, Anshuman Chandra, Lokesh Kori, Mahmoud A. A. Ibrahim, Amal Maurady (2023). Exploring natural products as multi-target-directed drugs for Parkinson’s disease: an in-silico approach integrating QSAR, pharmacophore modeling, and molecular dynamics simulations. Journal Article.
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Yassir Boulaamane, Kailash Jangid, Mohammed Reda Britel, Amal Maurady (2023). Probing the molecular mechanisms of α-synuclein inhibitors unveils promising natural candidates through machine-learning QSAR, pharmacophore modeling, and molecular dynamics simulations. Journal Article.
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Yassir Boulaamane, Pallavi Kandpal, Anshuman Chandra, Mohammed Reda Britel, Amal Maurady (2023). Chemical library design, QSAR modeling and molecular dynamics simulations of naturally occurring coumarins as dual inhibitors of MAO-B and AChE. Journal Article.
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Yassir Boulaamane, Mohammed Reda Britel, Amal Maurady (2023). Insights into the Structure-Activity Relationship of Alkynyl-Coumarinyl Ethers as Selective MAO-B Inhibitors Using Molecular Docking. Book Chapter.
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Suneeta Bhandari, Akansha Agrwal, Virendra Kasana, Shishir Tandon, Yassir Boulaamane, Amal Maurady (2022). β-amino carbonyl derivatives: Synthesis, Molecular Docking, ADMET, Molecular Dynamic and Herbicidal studies. Journal Article.
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Yassir Boulaamane, Mahmoud A. A. Ibrahim, Mohammed Reda Britel, Amal Maurady (2022). In silico studies of natural product-like caffeine derivatives as potential MAO-B inhibitors/AA2AR antagonists for the treatment of Parkinson's disease. Journal Article.
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Yassir Boulaamane, Iqrar Ahmad, Harun Patel, Niloy Das, Mohammed Reda Britel, Amal Maurady (2022). Structural exploration of selected C6 and C7-substituted coumarin isomers as selective MAO-B inhibitors. Journal Article.
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