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Biological and Medicinal Chemistry

Working Paper

Multiscale simulations identify origins of differential carbapenem hydrolysis by the OXA-48 β-lactamase

Viivi Hirvonen, Tal Moshe Weizmann, Adrian Mulholland, James Spencer, Marc van der Kamp

Version 2 posted 23 March 2022

318

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1

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Biological and Medicinal Chemistry

Working Paper

A Synthetic Antibiotic Scaffold Effective Against Multidrug-Resistant Bacterial Pathogens

Matthew Mitcheltree, Amarnath Pisipati, Egor A. Syroegin, Katherine J. Silvestre, Dorota Klepacki, Jeremy Mason, Daniel W. Terwilliger, Giambattista Testolin, Aditya R. Pote, Kelvin J. Y. Wu, Richard Porter Ladley, Kelly Chatman, Alexander S. Mankin, Yury S. Polikanov, Andrew G. Myers

Version 1 posted 30 March 2021

880

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3

Citations

Biological and Medicinal Chemistry

Working Paper

Mechanistic Investigations of Metallo-β-Lactamase Inhibitors: Strong Zinc Binding Is Not Required for Potent Enzyme Inhibition

Nicola Wade, Kamaleddin Tehrani, Nora Brüchle, Matthijs J. van Haren, Vida Mashayekhi, Nathaniel Martin

Version 1 posted 16 November 2020

417

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Inorganic Chemistry

Working Paper

Dynamic Interaction of Norfloxacin to Magnesium Monitored by Bacterial Outer Membrane Nanopores

Jiajun Wang, Jigneshkumar Dahyabhai Prajapati, Ulrich Kleinekathöfer, Mathias Winterhalter

Version 1 posted 19 May 2020

580

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Physical Chemistry

Working Paper

Elucidating the Molecular Basis of Avibactam Mediated Inhibition of Class A β-Lactamases

Chandan Kumar Das, Nisanth N. Nair

Version 1 posted 11 October 2019

636

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Theoretical and Computational Chemistry

Working Paper

Predicting antibiotic resistance in complex protein targets using alchemical free energy methods

Alice Brankin, Philip Fowler

Version 1 posted 15 December 2021

188

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Biological and Medicinal Chemistry

Working Paper

Transcriptomic Analysis of Loratadine as an Antibiotic Adjuvant Against MRSA

Brianna Viering, Halie Balogh, Luke Akers, Meghan Blackledge, Heather Miller

Version 1 posted 23 March 2023

125

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Biological and Medicinal Chemistry

Working Paper

Pyrimidine-2-amines increase susceptibility of methicillin-resistant Staphylococcus aureus to penicillin G

Payton Thomas, Margaret Deming, Aurijit Sarkar

Version 2 posted 28 March 2022

279

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Theoretical and Computational Chemistry

Review

Chemoinformatics and Artificial Intelligence Colloquium: Progress and Challenges to Develop Bioactive Compounds

Jürgen Bajorath, Ana L. Chávez-Hernández, Miquel Duran-Frigola, Eli Fernández-de Gortari, Johann Gasteiger, Edgar López-López, Gerald M. Maggiora, José L. Medina-Franco, Oscar Méndez-Lucio, Jordi Mestres, Ramón Alain Miranda-Quintana, Tudor I. Oprea, Fabien Plisson, Fernando D. Prieto-Martínez, Raquel Rodríguez-Pérez, Paola Rondón-Villarreal, Fernanda I. Saldívar-Gonzalez, Norberto Sánchez-Cruz, Marilia Valli

Version 2 posted 09 August 2022

773

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Biological and Medicinal Chemistry

Working Paper

Antimicrobial activity of self-assembled structures formed by protected amino acids

Nidhi Gour, Haren Gosai, Monisha Patel, Ajay Patel, Akshar Vaishnani

Version 1 posted 30 May 2023

159

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12 results in Antibiotic resistance in Keywords: Antibiotic resistance

Multiscale simulations identify origins of differential carbapenem hydrolysis by the OXA-48 β-lactamase

A Synthetic Antibiotic Scaffold Effective Against Multidrug-Resistant Bacterial Pathogens

Mechanistic Investigations of Metallo-β-Lactamase Inhibitors: Strong Zinc Binding Is Not Required for Potent Enzyme Inhibition

Dynamic Interaction of Norfloxacin to Magnesium Monitored by Bacterial Outer Membrane Nanopores

Elucidating the Molecular Basis of Avibactam Mediated Inhibition of Class A β-Lactamases

Predicting antibiotic resistance in complex protein targets using alchemical free energy methods

Transcriptomic Analysis of Loratadine as an Antibiotic Adjuvant Against MRSA

Pyrimidine-2-amines increase susceptibility of methicillin-resistant Staphylococcus aureus to penicillin G

Chemoinformatics and Artificial Intelligence Colloquium: Progress and Challenges to Develop Bioactive Compounds

Antimicrobial activity of self-assembled structures formed by protected amino acids

12 results in Keywords: Antibiotic resistance