Publications by authors named "Timothy Hasse"

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In Silico Discovery of Potential Inhibitors Targeting the MEIG1-PACRG Complex for Male Contraceptive Development.
Timothy Hasse, Zhibing Zhang, Yu-Ming M Huang

Proteins· September 2025

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In silico discovery of potential inhibitors targeting the MEIG1-PACRG complex for male contraceptive development.
Timothy Hasse, Zhibing Zhang, Yu-Ming M Huang

bioRxiv· December 2024

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Multiple Parameter Replica Exchange Gaussian Accelerated Molecular Dynamics for Enhanced Sampling and Free Energy Calculation of Biomolecular Systems.
Timothy Hasse, Yu-Ming M Huang

J Chem Theory Comput· August 2024

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Mechanistic insights into ligand dissociation from the SARS-CoV-2 spike glycoprotein.
Timothy Hasse, Esra Mantei, Rezvan Shahoei, Shristi Pawnikar, Jinan Wang

PLoS Comput Biol· March 2024

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Molecular dynamics study reveals key disruptors of MEIG1-PACRG interaction.
Timothy Hasse, Zhibing Zhang, Yu-Ming M Huang

Proteins· April 2023

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Synthesis and reactivity of a 4His enzyme model complex.
Jia Li, Atanu Banerjee, Timothy A Hasse, Reza Loloee, Shannon M Biros

RSC Adv· October 2017

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