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Physical Chemistry Chemical Physics : PCCP|April 17, 2025
Thermal degradation energetics of fentanyl and its analogues: furanyl fentanyl and ortho-fluoro fentanylBharat Poudel, Joshua J Whiting, Juan M Vanegas, et al.The Journal of Physical Chemistry. B|October 14, 2014
Hydration of Kr(aq) in Dilute and Concentrated SolutionsMangesh I Chaudhari, Dubravko Sabo, Lawrence R Pratt, et al.The Journal of Physical Chemistry. B|November 25, 2015
Dielectric Relaxation of Ethylene Carbonate and Propylene Carbonate from Molecular Dynamics SimulationsXinli You, Mangesh I Chaudhari, Susan B Rempe, et al.Biophysical Journal|March 16, 2017
Atomistic Study of Intramolecular Interactions in the Closed-State Channelrhodopsin Chimera, C1C2Monika R VanGordon, Gaurav Gyawali, Steven W Rick, et al.Topics in Current Chemistry (Cham)|February 14, 2018
Assessment of Simple Models for Molecular Simulation of Ethylene Carbonate and Propylene Carbonate as Solvents for Electrolyte SolutionsMangesh I Chaudhari, Ajay Muralidharan, Lawrence R Pratt, et al.Journal of the American Chemical Society|January 30, 2004
Hydration structure and free energy of biomolecularly specific aqueous dications, including Zn2+ and first transition row metalsD Asthagiri, Lawrence R Pratt, Michael E Paulaitis, et al.Chemical Science|September 14, 2018
Probing key elements of teixobactin-lipid II interactions in membranesPo-Chao Wen, Juan M Vanegas, Susan B Rempe, et al.The Journal of Physical Chemistry. B|December 16, 2025
Thermal Degradation Energy Landscapes of Fluorofentanyls: Probing the Mechanisms and Energetics of Bond BreakingBharat Poudel, Joshua J Whiting, Juan M Vanegas, et al.Biophysical Chemistry|September 23, 2003
Hydration of krypton and consideration of clathrate models of hydrophobic effects from the perspective of quasi-chemical theoryHenry S Ashbaugh, D Asthagiri, Lawrence R Pratt, et al.International Journal of Molecular Sciences|December 10, 2021
Enhancing Paraoxon Binding to Organophosphorus Hydrolase Active SiteLéa El Khoury, David L Mobley, Dongmei Ye, et al.Pageof 15