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  • Currently displaying 9681 - 9700 of 29265 publications
Author(s)
Publication title
Journal Name
Publication year
Effects of microstructures on hydrogen induced cracking of electrochemically hydrogenated double notched tensile sample of 4340 steel
MH Sk, RA Overfelt, AM Abdullah
Materials Science and Engineering A
(2016)
659
Nuclear Quantum Effects in Water and Aqueous Systems: Experiment, Theory, and Current Challenges
M Ceriotti, W Fang, PG Kusalik, RH McKenzie, A Michaelides, MA Morales, TE Markland
Chemical Reviews
(2016)
116
The Carbon-Water Interface: Modeling Challenges and Opportunities for the Water-Energy Nexus.
A Striolo, A Michaelides, L Joly
Annual Review of Chemical and Biomolecular Engineering
(2016)
7
Expanding DP4: application to drug compounds and automation.
K Ermanis, KEB Parkes, T Agback, JM Goodman
Organic & biomolecular chemistry
(2016)
14
Discovery of a small-molecule binder of the oncoprotein gankyrin that modulates gankyrin activity in the cell.
A Chattopadhyay, CJ O'Connor, F Zhang, C Galvagnion, WRJD Galloway, YS Tan, JE Stokes, T Rahman, C Verma, DR Spring, LS Itzhaki
Scientific reports
(2016)
6
Sampling free energy surfaces as slices by combining umbrella sampling and metadynamics
S Awasthi, V Kapil, NN Nair
J Comput Chem
(2016)
37
Computing the dielectric constant of liquid water at constant dielectric displacement
C Zhang, M Sprik
Physical Review B
(2016)
93
A general reaction network unifies the aggregation behaviour of the A$β$42 peptide and its variants
G Meisl, X Yang, CM Dobson, S Linse, TPJ Knowles
(2016)
pH-dependent ammonia removal pathways in microbial fuel cell system.
T Kim, J An, H Lee, JK Jang, IS Chang
Bioresour Technol
(2016)
215
Solvent-Free Continuous Operations Using Small Footprint Reactors: A Key Approach for Process Intensification
T Ouchi, RJ Mutton, V Rojas, DE Fitzpatrick, DG Cork, C Battilocchio, SV Ley
ACS Sustainable Chemistry and Engineering
(2016)
4
A general reaction network unifies the aggregation behaviour of the A$\beta$42 peptide and its variants
G Meisl, X Yang, CM Dobson, S Linse, TPJ Knowles
(2016)
On the application of the tolerance factor to inorganic and hybrid halide perovskites: a revised system.
W Travis, ENK Glover, H Bronstein, DO Scanlon, RG Palgrave
Chemical science
(2016)
7
The Adsorption of Synovene on ZDDP Wear Tracks: A Sum Frequency Generation (SFG) Vibrational Spectroscopy Study
MTL Casford, PB Davies, TD Smith, GL Bracchi
Tribology Letters
(2016)
62
Studies of the Capacity Fade Mechanisms of LiCoO2/Si-Alloy: Graphite Cells
R Petibon, VL Chevrier, CP Aiken, DS Hall, SR Hyatt, R Shunmugasundaram, JR Dahn
Journal of the Electrochemical Society
(2016)
163
Perspective: How good is DFT for water?
MJ Gillan, D Alfè, A Michaelides
Journal of Chemical Physics
(2016)
144
Reduction of oxygen in a trialkoxy ammonium-based ionic liquid and the role of water
C Pozo-Gonzalo, M Kar, E Jónsson, PC Howlett, DR MacFarlane, M Forsyth
Electrochimica Acta
(2016)
196
Corrigendum: Anion Recognition in Water: Recent Advances from a Supramolecular and Macromolecular Perspective
MJ Langton, CJ Serpell, PD Beer
Angewandte Chemie International Edition
(2016)
55
Structure-activity relationship of the peptide binding-motif mediating the BRCA2:RAD51 protein-protein interaction
DE Scott, M Marsh, TL Blundell, C Abell, M Hyvönen
FEBS Lett
(2016)
590
(Invited) Investigations into the Chemical Role of Additives in Li-Ion Cells
DS Hall, R Petibon, L Ellis, S Glazier, J Self, M Nie, L Madec, A Xiao, WM Lamanna, K Smith, JR Dahn
ECS Meeting Abstracts
(2016)
MA2016-01
Stratospheric ozone changes under solar geoengineering: implications for UV exposure and air quality
PJ Nowack, NL Abraham, P Braesicke, JA Pyle
Atmospheric Chemistry and Physics
(2016)
16