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Journal of Biomolecular Structure & Dynamics|November 13, 2024
An integrated bioinformatics approach to early diagnosis, prognosis and therapeutics of non-small-cell lung cancerAdiba Sultana, Md Shahin Alam, Alima Khanam, et al.Journal of Biomolecular Structure & Dynamics|November 12, 2024
Targeting mitochondrial dynamics: an in-silico approach for repurposing antifungal drugs in OSCC treatmentRohith Raali, Neha Sivakumar, Harsh Vardhan J, et al.Journal of Biomolecular Structure & Dynamics|June 24, 2024
Deciphering the conformational dynamics of Myelin Oligodendrocyte glycoprotein in the myelin sheathY K Ananya, L RamyaJournal of Biomolecular Structure & Dynamics|June 13, 2024
Identification of structural fingerprints among natural inhibitors of HDAC1 to accelerate nature-inspired drug discovery in cancer epigeneticsSourav Sardar, Jyotisha, Sk Abdul Amin, et al.Journal of Biomolecular Structure & Dynamics|June 19, 2024
Screening of bioactive compounds from selected mushroom species against putative drug targets in Mycobacterium tuberculosis: a multi-target approachAkshatha Prasanna, Prashantha Karunakar, Anushka Pillai, et al.Journal of Biomolecular Structure & Dynamics|November 3, 2023
System pharmacology-based determination of the functional components and mechanisms in chronic heart failure treatment: an example of Zhenwu decoctionYisheng Huang, Qinwen Liu, Meiyu Liu, et al.Journal of Biomolecular Structure & Dynamics|October 30, 2023
Molecular docking and dynamic simulation studies of isoflavones inhibiting Lox-2 activity for reducing beany flavor in soybean seedsEkta Patel, Pawan Kumar, Pragya Priyadarshini, et al.Journal of Biomolecular Structure & Dynamics|October 30, 2023
Synthesis, spectroscopic analysis, DFT, docking, MD and antioxidant activity of tetrahydrocurcuminYingqi Qiu, Yuanmeng Wang, Jiahao Lu, et al.Journal of Biomolecular Structure & Dynamics|November 3, 2023
In silico identification of five binding sites on the SARS-CoV-2 spike protein and selection of seven ligands for such sitesDenilson Ferreira de OliveiraJournal of Biomolecular Structure & Dynamics|November 3, 2023
Molecular docking, molecular dynamics and binding free energy based identification of novel potential multitarget inhibitors of Nipah virusPrashasti Sinha, Anil Kumar YadavPageof 935