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Journal of Biomolecular Structure & Dynamics|October 2, 2022
Drug repurposing against galectin-3 using simulation-based studiesGhulam Md Ashraf, Mohd Rehan, Alhuseen O Alsayed, et al.Journal of Biomolecular Structure & Dynamics|September 15, 2022
Assessment of tools for RNA secondary structure prediction and extraction: a final-user perspectiveMargherita A G Matarrese, Alessandro Loppini, Martina Nicoletti, et al.Journal of Biomolecular Structure & Dynamics|September 15, 2022
Experimental and computational evaluation of dipeptidyl peptidase III inhibitors based on quinazolinone-Schiff's basesDejan Agić, Maja Karnaš, Sanja Tomić, et al.Journal of Biomolecular Structure & Dynamics|September 15, 2022
Pharmacophore-based virtual screening, molecular docking, and molecular dynamics studies for the discovery of novel FLT3 inhibitorsMebarka Ouassaf, Ossama Daoui, Sarfaraz Alam, et al.Journal of Biomolecular Structure & Dynamics|September 16, 2022
Function identification and characterization of Oryza sativa ZRT and IRT-like proteins computationally for nutrition and biofortification in riceKhaled Fathy Abdelmotelb Mohammed, Tanushri Kaul, Pawan Kumar Agrawal, et al.Journal of Biomolecular Structure & Dynamics|September 19, 2022
Antichagasic evaluation, molecular docking and ADMET properties of the chalcone (2E)-3-(2-fluorophenyl)-1-(2-hydroxy- 3,4,6-trimethoxyphenyl)prop-2-en-1-one against Trypanosoma cruziCarlos Henrique Leitão Cavalcante, Francisco Wagner de Queiroz Almeida-Neto, Matheus Nunes da Rocha, et al.Journal of Biomolecular Structure & Dynamics|September 19, 2022
A binuclear Cu(I)-phosphine complex as a specific HSA site I binder: synthesis, X-ray structure determination, and a comprehensive HSA interaction analysisSaba HadidiJournal of Biomolecular Structure & Dynamics|September 19, 2022
Synthesis, spectroscopic characterization, density functional theory study, antimicrobial and antioxidant activities of curcumin and alanine-curcumin Schiff baseHoudheifa Layaida, Abdelkader Hellal, Nadjib Chafai, et al.Journal of Biomolecular Structure & Dynamics|September 19, 2022
Insight into molecular interaction between shrimp and white spot syndrome virus through MjsvCL-VP28 complex: an in-silico approachKanika Yadav, Arunima Kumar Verma, Sunita Gupta, et al.Journal of Biomolecular Structure & Dynamics|September 20, 2022
Structural dynamics of chlorpromazine (CPZ) drug with dipalmitoylphosphatidylcholine (DPPC) lipid: a potential drug for SARS-CoV-2Soni Mishra, Abhishek Kumar Mishra, Ramesh SharmaPageof 931