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Physical Chemistry Chemical Physics : PCCP|July 18, 2015
Energy landscapes of a hairpin peptide including NMR chemical shift restraintsJoanne M Carr, Chris S Whittleston, David C Wade, et al.Physical Chemistry Chemical Physics : PCCP|November 12, 2013
A conformational factorisation approach for estimating the binding free energies of macromoleculesKenji Mochizuki, Chris S Whittleston, Sandeep Somani, et al.The Journal of Physical Chemistry. B|March 3, 2006
Theory of C2Hx species on Pt{110}(1x2): structure, stability, and thermal chemistryAlexandra T Anghel, Stephen J Jenkins, David J Wales, et al.Biodata Mining|April 1, 2021
Prediction of short-term mortality in acute heart failure patients using minimal electronic health record dataAshwath Radhachandran, Anurag Garikipati, Nicole S Zelin, et al.Brain Informatics|March 2, 2023
Machine learning determination of applied behavioral analysis treatment plan typeJenish Maharjan, Anurag Garikipati, Frank A Dinenno, et al.Computers in Biology and Medicine|June 3, 2016
A computational approach to mortality prediction of alcohol use disorder inpatientsJacob Calvert, Qingqing Mao, Angela J Rogers, et al.Medicine|June 11, 2021
Predicting ventilator-associated pneumonia with machine learningChristine Giang, Jacob Calvert, Keyvan Rahmani, et al.The Journal of Physical Chemistry. B|July 24, 2008
Characterizing the first steps of amyloid formation for the ccbeta peptideBirgit Strodel, Anthony W Fitzpatrick, Michele Vendruscolo, et al.Physical Review. E|February 13, 2016
Turning intractable counting into sampling: Computing the configurational entropy of three-dimensional jammed packingsStefano Martiniani, K Julian Schrenk, Jacob D Stevenson, et al.Journal of the American Chemical Society|October 15, 2014
Direct observation of intermediates in a thermodynamically controlled solid-state dynamic covalent reactionAna M Belenguer, Giulio I Lampronti, David J Wales, et al.Pageof 30