EXPLICIT MOLECULAR DYNAMICS SIMULATION STUDIES TO DISCOVER NOVEL NATURAL COMPOUND ANALOGUES AS MYCOBACTERIUM TUBERCULOSIS INHIBITORS

Explicit molecular dynamics simulation studies to discover novel natural compound analogues as Mycobacterium tuberculosis inhibitors

Tuberculosis (TB) in one of the dreadful diseases present globally.This is caused by Mycobacterium tuberculosis.Mycobacterium tuberculosis dethiobiotin synthetase (MtDTBS) is an essential enzyme in biotin biosynthesis and is an ideal target to design and develop novel inhibitors.In order to effectively combat this disease six natural compound (bute

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Quantitative Prediction of Human Pharmacokinetics and Pharmacodynamics of CKD519, a Potent Inhibitor of Cholesteryl Ester Transfer Protein (CETP)

CKD519, a selective inhibitor of cholesteryl ester transfer protein(CETP), is undergoing development as an oral agent for the treatment of primary hypercholesterolemia and mixed hyperlipidemia.The aim of this study was to predict the appropriate efficacious dose of CKD519 for humans in terms of the inhibition of CETP activity by developing a CKD519

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Partial Atomic Model of the Tailed Lactococcal Phage TP901-1 as Predicted by AlphaFold2: Revelations and Limitations

Bacteria are engaged in a constant battle against preying viruses, called bacteriophages (or phages).These remarkable nano-machines pack and utvara hellkite price store their genomes in a capsid and inject it into the cytoplasm of their bacterial prey following specific adhesion to the host cell surface.Tailed phages possessing dsDNA genomes are th

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