Results 11 to 20 of about 141,530 (234)
Computer aided drug design in the development of proteolysis targeting chimeras. [PDF]
Comput Struct Biotechnol J, 2023 Proteolysis targeting chimeras represent a class of drug molecules with a number of attractive properties, most notably a potential to work for targets that, so far, have been in-accessible for conventional small molecule inhibitors.
Tunjic TM, Weber N, Brunsteiner M.
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Recent advances from computer-aided drug design to artificial intelligence drug design. [PDF]
RSC Med ChemComputer-aided drug design (CADD), a cornerstone of modern drug discovery, can predict how a molecular structure relates to its activity and interacts with its target using structure-based and ligand-based methods.
Wang K, Huang Y, Wang Y, You Q, Wang L.
europepmc +2 more sources
Computer-Aided Drug Design Methods [PDF]
Methods in molecular biology, 2017 Computational approaches are useful tools to interpret and guide experiments to expedite the antibiotic drug design process. Structure based drug design (SBDD) and ligand based drug design (LBDD) are the two general types of computer-aided drug design ...
Wenbo Yu, Alexander D. MacKerell
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Computer-Aided Drug Design Boosts RAS Inhibitor Discovery. [PDF]
Molecules, 2022 The Rat Sarcoma (RAS) family (NRAS, HRAS, and KRAS) is endowed with GTPase activity to regulate various signaling pathways in ubiquitous animal cells. As proto-oncogenes, RAS mutations can maintain activation, leading to the growth and proliferation of ...
Wang G +5 more
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International Journal of Advanced Research in Science, Communication and Technology, 2022 Computational approaches in drug style, discovery and admiration. Generally, drug discovery takes an extended Duration of your time amount Ni twelve year and billon of capital. It includes the making of recent molecules, docking Molecules to focus on macromolecule, analyzing molecular interaction, estimating binding strength and drug properties ...
Aras, Merve, Yayıntaş, Özlem
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An Updated Review of Computer-Aided Drug Design and Its Application to COVID-19
BioMed Research International, 2021 The recent outbreak of the deadly coronavirus disease 19 (COVID-19) pandemic poses serious health concerns around the world. The lack of approved drugs or vaccines continues to be a challenge and further necessitates the discovery of new therapeutic ...
A. Gurung +4 more
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Computer-Aided Drug Design in Epigenetics [PDF]
Frontiers in Chemistry, 2018 Epigenetic dysfunction has been widely implicated in several diseases especially cancers thus highlights the therapeutic potential for chemical interventions in this field. With rapid development of computational methodologies and high-performance computational resources, computer-aided drug design has emerged as a promising strategy to speed up ...
Wenchao Lu +9 more
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Big data and artificial intelligence (AI) methodologies for computer-aided drug design (CADD)
Biochemical Society Transactions, 2022 There have been numerous advances in the development of computational and statistical methods and applications of big data and artificial intelligence (AI) techniques for computer-aided drug design (CADD).
Jai Woo Lee +4 more
semanticscholar +1 more source
Frontiers in Cellular and Infection Microbiology, 2022 The severe acute respiratory syndrome coronavirus 2 (SARS-CoV-2) has caused a substantial number of deaths around the world, making it a serious and pressing public health hazard.
M. Rahman +15 more
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