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International Journal of Molecular Sciences|July 14, 2023
Energy Landscapes and Heat Capacity Signatures for Monomers and Dimers of Amyloid-Forming HexapeptidesNicy, David J WalesThe Journal of Chemical Physics|July 25, 2016
Effect of total and pair configurational entropy in determining dynamics of supercooled liquids over a range of densitiesAtreyee Banerjee, Manoj Kumar Nandi, Srikanth Sastry, et al.The Journal of Chemical Physics|July 25, 2016
Composition dependence of the glass forming ability in binary mixtures: The role of demixing entropyUjjwal Kumar Nandi, Atreyee Banerjee, Suman Chakrabarty, et al.Soft Matter|March 8, 2022
Finite-size scaling and thermodynamics of model supercooled liquids: long-range concentration fluctuations and the role of attractive interactionsAtreyee Banerjee, Mauricio Sevilla, Joseph F Rudzinski, et al.Physical Review Letters|January 13, 2018
Role of the Pair Correlation Function in the Dynamical Transition Predicted by Mode Coupling TheoryManoj Kumar Nandi, Atreyee Banerjee, Chandan Dasgupta, et al.The Journal of Chemical Physics|July 17, 2017
Determination of onset temperature from the entropy for fragile to strong liquidsAtreyee Banerjee, Manoj Kumar Nandi, Srikanth Sastry, et al.Physical Review. E|July 15, 2016
Energy landscapes for a machine-learning prediction of patient dischargeRitankar Das, David J WalesJournal of Chemical Theory and Computation|February 7, 2023
Molecular Energy Landscapes of Hardware-Efficient Ansätze in Quantum ComputingBoy Choy, David J WalesThe Journal of Physical Chemistry. B|March 21, 2017
Improving Computational Predictions of Single-Stranded RNA Tetramers with Revised α/γ Torsional Parameters for the Amber Force FieldDavid J Wales, Ilyas YildirimBiochemistry|September 29, 2018
Analysis of the Ub to Ub-CR Transition in UbiquitinKonstantin Röder, David J WalesPageof 26