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Molecular Diversity|September 11, 2024
Environmental pollutant Di-(2-ethylhexyl) phthalate induces asthenozoospermia: new insights from network toxicologyLei Xu, Menghua Shi, Guozheng Qin, et al.
Molecular Diversity|September 30, 2024
Comprehensive investigation of network pharmacology, computational modeling, and pharmacokinetic assessment to evaluate the efficacy of flavonoids in rheumatoid arthritisSukanya Vijayan, Thirumal Margesan
Molecular Diversity|September 16, 2024
Design, synthesis, bioactivity and action mechanism of N-substituted N'-phenylpicolinohydrazides against phytopathogenic fungiYuhao Zhang, Ruofei Bai, Tengyi Du, et al.
Molecular Diversity|September 18, 2024
A network pharmacology-based approach to understand the mechanism of action of anti-mycobacterial activity of Acacia nilotica: a modelling and experimental studyMadhumitha Suresh, Kadambari Vijay Sai, Kartik Mitra, et al.
Molecular Diversity|October 8, 2024
Synthesis and antifungal activities of small molecule arylthiazolamine derivativesXu Zhong, Jian He, Taigui Ma, et al.
Molecular Diversity|October 18, 2024
Computational screening of umami tastants using deep learningPrantar Dutta, Kishore Gajula, Nitu Verma, et al.
Molecular Diversity|October 9, 2024
Taiwan Chingguan Yihau may improve post-COVID-19 respiratory complications through PI3K/AKT, HIF-1, and TNF signaling pathways revealed by network pharmacology analysisDung Tam Nguyen Huynh, Hien Thi Nguyen, Chien-Ming Hsieh
Molecular Diversity|August 17, 2024
Chemical analogue based drug design for cancer treatment targeting PI3K: integrating machine learning and molecular modelingMohammed A Bazuhair, Anwar A Alghamdi, Othman Baothman, et al.
Molecular Diversity|August 17, 2024
(-)-Epicatechin metabolites as a GPER ligands: a theoretical perspectiveRodolfo Daniel Ávila-Avilés, Erick Bahena-Culhuac, J Manuel Hernández-Hernández
Molecular Diversity|August 16, 2024
Identification of mycobacterial Thymidylate kinase inhibitors: a comprehensive pharmacophore, machine learning, molecular docking, and molecular dynamics simulation studiesRupesh V Chikhale, Surbhi Pravin Pawar, Mahima Sudhir Kolpe, et al.
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