Global ETD Search
Search theses and dissertations gathered from participating repositories worldwide. Every result links back to the library that holds it. No account is needed.
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Showing 1 to 6 of 6 for “"mpro"”.
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Advancement in In-Silico Drug Discovery from Virtual Screening Molecular Dockings to De-Novo Drug Design Transformer-based Generative AI and Reinforcement Learning
… the design of novel inhibitors for the COVID-19 Mpro using a transformer-based de novo design framework. The researchers used a transformer encoder-decoder model to generate potential inhibitors and employed MCTS to iteratively refine these candidates. This innovative approach yielded several …
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LOW-COST STRUCTURED-LIGHT 3D CAPTURE SYSTEM DESIGN
… the M275. We augment this hardware with two 3M MPro 150 VGA (640×480) pocket projectors. We also describe an analytical approach to predicting the achievable resolution of the reconstructed 3D object based on differentials and small signal theory, and an experimental procedure for validating …
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Synthese und Testung nichtpeptidischer Cystein-Protease-Inhibitoren - Etacrynsäure als Leitstruktur
… humanen SARS-Coronavirus Hauptprotease (SARS-CoV Mpro) wurden Docking-Experimente mit Etacrynsäure-tertbutylamid an der humanen SARS-Coronavirus Hauptprotease (SARS-CoV Mpro) durchgeführt. Die Ergebnisse führten zur Synthese einer modifizierten Verbindung, die eine geringe Verbesserung der …
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Accelerating the Design-Make-Test cycle of Drug Discovery with Machine Learning
… we prospectively find novel hits for SARS-CoV-2 Mpro and the Mac1 domain of SARS-CoV-2 non-structural protein 3 by screening a library of 1 billion molecules. After identifying hit compounds, we enter the hit-to-lead stage where we wish to optimise their molecular structures to improve …
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DESIGN, SYNTHESIS AND BIOLOGICAL PROFILING OF NEW COMPOUNDS: INFECTIOUS AND NEURODEGENERATIVE DISEASES AS TARGETS
… centered on the SARS-CoV-2 main protease (Mpro), a catalytic enzyme indispensable for the maturation of viral proteins essential for viral replication within host cells. Recognizing the critical role of Mpro in the viral life cycle, I endeavored to harness the power of medicinal chemistry …