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Journal of Biomolecular Structure & Dynamics|October 30, 2022
Structural and spectroscopic details of polysaccharide-bile acid composites from molecular dynamics simulationsSruthi Peesapati, Durba RoyJournal of Biomolecular Structure & Dynamics|November 3, 2022
An insight into the binding and inhibition of eye ζ-crystallin by the environmental toxin arsenic: implications in eye diseasesMd Amiruddin Hashmi, Ajamaluddin Malik, Faizan Abul Qais, et al.Journal of Biomolecular Structure & Dynamics|September 22, 2022
Structure-based virtual screening, molecular docking, molecular dynamics simulation and MM/PBSA calculations towards identification of steroidal and non-steroidal selective glucocorticoid receptor modulatorsFateme Zare, Aida Solhjoo, Hossein Sadeghpour, et al.Journal of Biomolecular Structure & Dynamics|September 23, 2022
Computational analysis of immunogenic epitopes in the p30 and p54 proteins of African swine fever virusMohamed Imdhiyas, Suvam Sen, Nagendra Barman, et al.Journal of Biomolecular Structure & Dynamics|September 24, 2022
A molecular docking-based comparative assessment of various anticholinergic drugs as antidotes to different nerve agent poisoningBishwajit Das, Durjoy MajumderJournal of Biomolecular Structure & Dynamics|September 24, 2022
How do the mutations in PfK13 protein promote anti-malarial drug resistance?Shikha Sharma, Md Ehesan AliJournal of Biomolecular Structure & Dynamics|October 17, 2022
In-silico investigations on the anticancer activity of selected 2-aryloxazoline derivatives against breast cancerMoly Rani, Ashutosh Nath, Ajoy KumerJournal of Biomolecular Structure & Dynamics|September 12, 2022
Interaction of MnTOEtPyP4 porphyrin with DNAGayane V Ananyan, Yeva B Dalyan, Nelli H Karapetyan, et al.Journal of Biomolecular Structure & Dynamics|July 4, 2012
Conformational analysis of GT1B ganglioside and its interaction with botulinum neurotoxin type B: a study by molecular modeling and molecular dynamicsSureshkumar Venkateshwari, Kasinadar VelurajaJournal of Biomolecular Structure & Dynamics|July 19, 2012
Prediction of inter domain interactions in modular polyketide synthases by docking and correlated mutation analysisGitanjali Yadav, Swadha Anand, Debasisa MohantyPageof 931