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Integration of Computational and Experimental Techniques for the Discovery of SARS-CoV-2 PLpro Covalent Inhibitors

Ho Ying Huang, Sharon Pinus, Xiao Cong Zhang, Guanyu Wang, Andrés M Rueda, Yaouba Souaibou, Solène Huck, Mitchell Huot, Danielle Vlaho, Joshua Pottel, Felipe Venegas, Zhuoqun Lu, Christopher Hennecker, Julia Stille, Jevgenijs Tjutrins, Caitlin Miron, Anne Labarre, Jessica Plescia, Mihai Burai-Patrascu, Anthony Mittermaier, Nicolas Moitessier

Version 1 posted 15 September 2023

321

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Biological and Medicinal Chemistry

Working Paper

Structure-Based Optimization and Biological Evaluation of SARS-CoV-2 3CLpro Covalent Inhibitors

Guanyu Wang, Julia Stille, Richard Boulon, Christopher Hennecker, Xiaocong Zhang, Nicole Blaine, Steven Laplante, Anthony Mittermaier, Nicolas Moitessier

Version 1 posted 18 September 2024

113

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Biological and Medicinal Chemistry

Working Paper

Design, Synthesis and Biological Evaluation of Novel SARS-CoV-2 3CLpro Covalent Inhibitors

Julia Stille, Jevgenijs Tjutrins, Guanyu Wang, Felipe A. Venegas, Christopher Hennecker, Andres Mauricio Rueda, Itai Sharon, Nicole Blaine, Caitlin E. Miron, Sharon Pinus, Anne Labarre, Jessica Plescia, Mihai Burai Patrascu, Xiaocong Zhang, Alexander S. Wahba, Danielle Vlaho, Mitchell Huot, T. Martin Schmeing, Anthony K Mittermaier, Nicolas Moitessier

Version 3 posted 14 September 2021

2,131

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Biological and Medicinal Chemistry

Working Paper

Minimizing Product Inhibition in DNA Self-Replication: Insights for Prebiotic Replication from the Role of the Enzyme in Lesion-Induced DNA Amplification

Hansol Park, Shyam Parshotam, Sarah Hales, Anthony Mittermaier, Julianne Gibbs

Version 2 posted 21 December 2022

182

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Analytical Chemistry

Working Paper

Using transient equilibria (TREQ) to measure the thermodynamics of slowly assembling supramolecular systems

Christopher Hennecker, Christophe Lachance-Brais, Hanadi Sleiman, Anthony Mittermaier

Version 2 posted 15 October 2021

568

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Biological and Medicinal Chemistry

Working Paper

Computer-aided design, synthesis, and biological evaluation of [4.3.0] bicyclic prolyl oligopeptidase and fibroblast activation protein-α dual inhibitors

Nicolas Moitessier, Jessica Plescia, Damien Hedou, Maud Pousse, Anne Labarre, Caroline Dufresne, Anthony Mittermaier

Version 1 posted 30 August 2021

462

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Materials Chemistry

Working Paper

pH-sulfate synergy regulates processing and mechanics of mussel byssus protein condensates

Hamideh R. Alanagh, Magda G. Sánchez-Sánchez, Michael R. Wozny, Yeganeh Habibi, Candace Jarade, Tara Sprules, Mike Strauss, Anthony Mittermaier, Adam G. Hendricks, Matthew J. Harrington

Version 1 posted 01 August 2024

162

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Biological and Medicinal Chemistry

Working Paper

Docking-based Virtual Screening for the Discovery of RNA-targeting Molecules: Identification of Selective Riboswitch Binding Ligands

Julia Stille, Nathania Takyi, Omma Ayon, Maira Rivera, Thershan Satkunarajah, Joshua Pottel, Anthony Mittermaier, Maureen McKeague, Nicolas Moitessier

Version 1 posted 26 June 2024

231

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8 results in Anthony Mittermaier in Authors: Anthony Mittermaier

Integration of Computational and Experimental Techniques for the Discovery of SARS-CoV-2 PLpro Covalent Inhibitors

Structure-Based Optimization and Biological Evaluation of SARS-CoV-2 3CLpro Covalent Inhibitors

Design, Synthesis and Biological Evaluation of Novel SARS-CoV-2 3CLpro Covalent Inhibitors

Minimizing Product Inhibition in DNA Self-Replication: Insights for Prebiotic Replication from the Role of the Enzyme in Lesion-Induced DNA Amplification

Using transient equilibria (TREQ) to measure the thermodynamics of slowly assembling supramolecular systems

Computer-aided design, synthesis, and biological evaluation of [4.3.0] bicyclic prolyl oligopeptidase and fibroblast activation protein-α dual inhibitors

pH-sulfate synergy regulates processing and mechanics of mussel byssus protein condensates

Docking-based Virtual Screening for the Discovery of RNA-targeting Molecules: Identification of Selective Riboswitch Binding Ligands

8 results in Authors: Anthony Mittermaier