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Yusuf Hamied Department of Chemistry

 

Teaching Fellow

Publications

Global analysis of energy landscapes for materials modeling: A test case for C60.
G Csányi, JWR Morgan, DJ Wales
– Journal of Chemical Physics
(2023)
159,
104107
Energy landscapes for proteins described by the UNRES coarse-grained potential.
PA Wesołowski, AK Sieradzan, MJ Winnicki, JWR Morgan, DJ Wales
– Biophysical Chemistry
(2023)
303,
107107
Exploring energy landscapes for solid-state systems with variable cells at the extended tight-binding level
P Pracht, JWR Morgan, DJ Wales
– J Chem Phys
(2023)
159,
064801
Enhancing Biomolecular Simulations with Hybrid Potentials Incorporating NMR Data
G Qi, MD Vrettas, C Biancaniello, M Sanz-Hernandez, CT Cafolla, JWR Morgan, Y Wang, A De Simone, DJ Wales
– J Chem Theory Comput
(2022)
18,
7733
On the capacity and superposition of minima in neural network loss function landscapes
MP Niroomand, JWR Morgan, CT Cafolla, DJ Wales
– Machine Learning: Science and Technology
(2022)
3,
025004
Characterising the Area Under the Curve Loss Function Landscape
MP Niroomand, CT Cafolla, JWR Morgan, DJ Wales
– Machine Learning: Science and Technology
(2022)
3,
015019
The alchemical energy landscape for a pentameric cluster.
JWR Morgan, SC Glotzer
– J Chem Phys
(2020)
152,
014106
Morphological analysis of chiral rod clusters from a coarse-grained single-site chiral potential
BJ Sutherland, SW Olesen, H Kusumaatmaja, JWR Morgan, DJ Wales
– Soft matter
(2019)
15,
8147
Morphological analysis of chiral rod clusters from a coarse-grained single-site chiral potential
BJ Sutherland, SW Olesen, H Kusumaatmaja, JWR Morgan, DJ Wales
(2019)
Energy Landscapes for Digital Alchemy
JWR Morgan, SC Glotzer
(2019)
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Research Group

Research Interest Group

Telephone number

01223 763067