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Molecular Diversity|December 20, 2024
A comprehensive computer-based assessment of Deacetylnomilin as an inhibitor for antibiotic-resistant genes identified from the whole genome sequence of the multidrug-resistant Enterobacter cloacae isolate 1382Shubhi Singh, Sahithya Selvakumar, Priya Swaminathan
Molecular Diversity|December 16, 2024
Leveraging machine learning to predict drug permeation: impact of menthol and limonene as enhancersManisha Yadav, Baddipadige Raju, Gera Narendra, et al.
Molecular Diversity|December 27, 2024
Design, synthesis, antifungal, and antibacterial evaluation of ferulic acid derivatives bearing amide moietyQiang Fei, Yanbi Luo, Haijiang Chen, et al.
Molecular Diversity|February 12, 2025
A review on pyrimidine-based pharmacophore as a template for the development of hybrid drugs with anticancer potentialShivam Sharma, M Arockia Babu, Roshan Kumar, et al.
Molecular Diversity|February 3, 2025
Evaluation of selected indigenous spices- and herbs-derived small molecules as potential inhibitors of SREBP and its implications for breast cancer using MD simulations and MMPBSA calculationsUrvashi Tiwari, Salman Akhtar, Snober S Mir, et al.
Molecular Diversity|February 3, 2025
Discovery of novel A2AR antagonist via 3D-QSAR pharmacophore modeling: neuroprotective effects in 6-OHDA-induced SH-SY5Y cells and haloperidol-induced Parkinsonism in C57 bl/6 miceAnkit Singh, Amresh Prakash, Jyoti Mishra, et al.
Molecular Diversity|February 15, 2025
Machine learning and cheminformatics-based Identification of lichen-derived compounds targeting mutant PBP4R200L in Staphylococcus aureusShalini Mathpal, Tushar Joshi, P Priyamvada, et al.
Molecular Diversity|January 28, 2025
Inhibition of amyloid-beta aggregation by phenyl butyric acid analogs and bile acids: a comprehensive in silico studyRimaljot Singh, Navpreet Kaur, Shiwani Sharma, et al.
Molecular Diversity|January 28, 2025
Bioinformatics and immunoinformatics approaches in the design of a multi-epitope vaccine targeting CTLA-4 for melanoma treatmentFatima Noor, Samiah Shahid, Muskan Fatima, et al.
Molecular Diversity|January 30, 2025
Explanatory review on DDR inhibitors: their biological activity, synthetic route, and structure-activity relationshipSindhuja Sengupta, Lalmohan Maji, Pronoy Kanti Das, et al.
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