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Physical Chemistry Chemical Physics : PCCP|January 20, 2018
Effects of carotenoids on lipid bilayersQuentin R Johnson, Barmak Mostofian, Gabriel Fuente Gomez, et al.Chemistry (Weinheim an Der Bergstrasse, Germany)|September 1, 2007
Force-field development and molecular dynamics simulations of ferrocene-peptide conjugates as a scaffold for hydrogenase mimicsXavier de Hatten, Zoe Cournia, Ivan Huc, et al.Biophysical Journal|December 12, 2025
Allosteric prediction via convolutional neural networks and protein structural and dynamical featuresRajitha Rajeshwar T, John H Lagergren, Jeremy C Smith, et al.Journal of Chemical Information and Modeling|June 6, 2025
Deep Learning Approaches for Predicting the Surface Tension of Ionic LiquidsNikhitha Gugulothu, Mood Mohan, Madaline R Marland, et al.The Journal of Chemical Physics|June 1, 2023
Predictive understanding of the surface tension and velocity of sound in ionic liquids using machine learningMood Mohan, Micholas Dean Smith, Omar Demerdash, et al.The Journal of Membrane Biology|March 9, 2018
Catalysis of Ground State cis[Formula: see text] trans Isomerization of Bacteriorhodopsin's Retinal Chromophore by a Hydrogen-Bond NetworkNadia Elghobashi-Meinhardt, Prasad Phatak, Ana-Nicoleta Bondar, et al.The Journal of Physical Chemistry. B|April 12, 2014
Hydrolysis of DFP and the nerve agent (S)-sarin by DFPase proceeds along two different reaction pathways: implications for engineering bioscavengersTroy Wymore, Martin J Field, Paul Langan, et al.Biorxiv : the Preprint Server for Biology|September 4, 2024
GPRC6A is a Potential Therapeutic Target for Metformin Regulation of Glucose Homeostasis in MiceMin Pi, Rupesh Agarwal, Micholas Dean Smith, et al.Science Advances|October 21, 2016
Determination of functional collective motions in a protein at atomic resolution using coherent neutron scatteringLiang Hong, Nitin Jain, Xiaolin Cheng, et al.Biophysical Journal|June 14, 2020
Mesophilic Pyrophosphatase Function at High Temperature: A Molecular Dynamics Simulation StudyRupesh Agarwal, Utsab R Shrestha, Xiang-Qiang Chu, et al.Pageof 35