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Yassir Boulaamane
Yassir Boulaamane
Ph.D. in Cheminformatics, Abdelmalek Essaadi University, Tetouan
在 etu.uae.ac.ma 的电子邮件经过验证 - 首页
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Structural exploration of selected C6 and C7-substituted coumarin isomers as selective MAO-B inhibitors
Y Boulaamane, I Ahmad, H Patel, N Das, MR Britel, A Maurady
Journal of Biomolecular Structure and Dynamics 41 (6), 2326-2340, 2023
372023
In silico studies of natural product-like caffeine derivatives as potential MAO-B inhibitors/AA2AR antagonists for the treatment of Parkinson's disease
Y Boulaamane, MAA Ibrahim, MR Britel, A Maurady
Journal of Integrative Bioinformatics 19 (4), 20210027, 2022
172022
Chemical library design, QSAR modeling and molecular dynamics simulations of naturally occurring coumarins as dual inhibitors of MAO-B and AChE
Y Boulaamane, P Kandpal, A Chandra, MR Britel, A Maurady
Journal of Biomolecular Structure and Dynamics 42 (4), 1629-1646, 2024
102024
β‐amino carbonyl derivatives: Synthesis, Molecular Docking, ADMET, Molecular Dynamic and Herbicidal studies.
S Bhandari, A Agrwal, V Kasana, S Tandon, Y Boulaamane, A Maurady
ChemistrySelect 7 (48), e202201572, 2022
72022
Probing the molecular mechanisms of α-synuclein inhibitors unveils promising natural candidates through machine-learning QSAR, pharmacophore modeling, and molecular dynamics …
Y Boulaamane, K Jangid, MR Britel, A Maurady
Molecular Diversity, 1-17, 2023
52023
Identification of novel dual acting ligands targeting the adenosine A2A and serotonin 5-HT1A receptors
I Touati, M Abdalla, Y Boulaamane, N Al-Hoshani, A Alouffi, MR Britel, ...
Journal of Biomolecular Structure and Dynamics, 1-16, 2023
32023
Antibiotic discovery with artificial intelligence for the treatment of Acinetobacter baumannii infections
Y Boulaamane, I Molina Panadero, A Hmadcha, C Atalaya Rey, ...
Msystems, e00325-24, 2024
22024
Exploring natural products as multi-target-directed drugs for Parkinson’s disease: an in-silico approach integrating QSAR, pharmacophore modeling, and molecular …
Y Boulaamane, I Touati, N Goyal, A Chandra, L Kori, MAA Ibrahim, ...
Journal of Biomolecular Structure and Dynamics, 1-18, 2023
22023
In silico Discovery of Dual Ligands Targeting MAO-B and AA2AR from African Natural Products Using Pharmacophore Modelling, Molecular Docking, and …
Y Boulaamane, I Touati, I Qamar, I Ahmad, H Patel, A Chandra, MR Britel, ...
Chemistry Africa, 1-23, 2024
2024
Dendrobium nobile alkaloids modulate calcium dysregulation and neuroinflammation in Alzheimer's disease: A bioinformatic analysis
I Touati, Y Boulaamane, MR Britel, A Maurady
Pharmacological Research-Modern Chinese Medicine 12, 100495, 2024
2024
Identification of Natural Inhibitors of SARS-CoV-2 Main Protease (Mpro) via Structure-Based Virtual Screening and Molecular Dynamics Simulations
Y Boulaamane, I Touati, B Sadoq, S Agarwal, A Chandra, MR Britel, ...
2024
EnsembleBBB: Enhanced accuracy in predicting drug blood-brain barrier permeability with a Machine Learning Ensemble model
Y Boulaamane, A Maurady
2023
Antibiotic discovery with artificial intelligence for the treatment of Acinetobacter baumannii infections
Y Smani, Y Boulaamane, IM Panadero, A Hmadcha, CA Rey, S Baammi, ...
2023
Insights into the Structure-Activity Relationship of Alkynyl-Coumarinyl Ethers as Selective MAO-B Inhibitors Using Molecular Docking
Y Boulaamane, MR Britel, A Maurady
2023
Computational Exploration of Acefylline Derivatives as MAO-B Inhibitors for Parkinson's disease: Insights from Molecular Docking, DFT, ADMET, and Molecular Dynamics Approaches
A Irfan, Y Ali, Y Boulaamane, S Javed, H Hameed, AF Zahoor, A Maurady, ...
Frontiers in Chemistry 12, 1449165, 0
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