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UnknownIdentification of a novel dual-target scaffold for 3CLpro and RdRp proteins of SARS-CoV-2 using 3D-similarity search, molecular docking, molecular dynamics and ADMET evaluation.
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S-EPMC7309310 | biostudies-literature
UnknownMolecular docking analysis of N-substituted Oseltamivir derivatives with the SARS-CoV-2 main protease.
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S-EPMC7434956 | biostudies-literature
UnknownPrediction and Structural Comparison of Deleterious Coding Nonsynonymous Single Nucleotide Polymorphisms (nsSNPs) in Human LEP Gene Associated with Obesity.
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S-EPMC6913293 | biostudies-literature
UnknownData for the spatiotemporal analysis of US global banks' exposure to foreign counterparty risks.
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S-EPMC6551556 | biostudies-literature
UnknownCamphor, Artemisinin and Sumac Phytochemicals as inhibitors against COVID-19: Computational approach.
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S-EPMC8354799 | biostudies-literature
UnknownIn silico detection of potential inhibitors from vitamins and their derivatives compounds against SARS-CoV-2 main protease by using molecular docking, molecular dynamic simulation and ADMET profiling.
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S-EPMC8855669 | biostudies-literature
UnknownChitinase-functionalized UiO-66 framework nanoparticles active against multidrug-resistant Candida Auris.
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S-EPMC11264975 | biostudies-literature
UnknownEfficient Synthesis of 1H-Benzo[4,5]imidazo[1,2-c][1,3]oxazin-1-one Derivatives Using Ag2CO3/TFA-Catalyzed 6-endo-dig Cyclization: Reaction Scope and Mechanistic Study.
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S-EPMC10005794 | biostudies-literature
UnknownComparative evaluation of antioxidant activity, total phenolic content, anti-inflammatory, and antibacterial potential of Euphorbia-derived functional products.
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S-EPMC10919402 | biostudies-literature
UnknownFacile synthesis, crystal structure, biological evaluation, and molecular modeling studies of N-((4-acetyl phenyl) carbamothioyl) pivalamide as the multitarget-directed ligand.
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S-EPMC9549587 | biostudies-literature
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