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  • Currently displaying 9061 - 9080 of 29865 publications
Author(s)
Publication title
Journal Name
Publication year
The Nature of the Mechanical Bond. From Molecules to Machines Von Carson J. Bruns und J. Fraser Stoddart.
JR Nitschke
Angewandte Chemie
(2016)
129
Application to large systems: general discussion.
S Althorpe, G Angulo, RD Astumian, V Beniwal, PG Bolhuis, J Brandão, J Ellis, W Fang, DR Glowacki, S Hammes-Schiffer, TJH Hele, H Jónsson, T Lelièvre, N Makri, D Manolopoulos, AM Mebel, G Menzl, TF Miller, M Parrinello, PM Piaggi, E Pollak, P Roy Chowdhury, E Sanz, D Shalashilin, E Skúlason, R Spezia, S Taraphder
Faraday Discuss
(2016)
195
Editorial: The Future of Chemical Physics Conference 2016.
A Michaelides, DE Manolopoulos, C Vega, P Hamm, DW Chandler, EC Brigham, MI Lester
The Journal of chemical physics
(2016)
145
The topology, structure and PE interaction of LITAF underpin a Charcot-Marie-Tooth disease type 1C
AK Ho, JL Wagstaff, PT Manna, L Wartosch, S Qamar, EF Garman, SMV Freund, RC Roberts
BMC biology
(2016)
14
Kinetics of spontaneous filament nucleation via oligomers: Insights from theory and simulation.
A Šarić, TCT Michaels, A Zaccone, TPJ Knowles, D Frenkel
The Journal of Chemical Physics
(2016)
145
Preface: Special Topic on Nucleation: New Concepts and Discoveries
KF Kelton, D Frenkel
The Journal of chemical physics
(2016)
145
Evidence for stable square ice from quantum Monte Carlo
J Chen, A Zen, JG Brandenburg, D Alfè, A Michaelides
Physical Review B
(2016)
94
Identification of critical paralog groups with indispensable roles in the regulation of signaling flow
D Modos, J Brooks, D Fazekas, E Ari, T Vellai, P Csermely, T Korcsmaros, K Lenti
Scientific reports
(2016)
6
The Significance of the Location of Mutations for the Native-State Dynamics of Human Lysozyme.
M Ahn, CL Hagan, A Bernardo-Gancedo, E De Genst, FN Newby, J Christodoulou, A Dhulesia, M Dumoulin, CV Robinson, CM Dobson, JR Kumita
Biophysical Journal
(2016)
111
Controlled supramolecular structure of guanosine monophosphate in the interlayer space of layered double hydroxide
G-H Gwak, I Kocsis, Y-M Legrand, M Barboiu, J-M Oh
Beilstein journal of nanotechnology
(2016)
7
Controllable Supramolecular Polymerization Promoted by Host-Enhanced Photodimerization.
Y Kang, Z Cai, Z Huang, X Tang, J-F Xu, X Zhang
ACS Macro Letters
(2016)
5
A novel applicability domain technique for mapping predictive reliability across the chemical space of a QSAR: reliability-density neighbourhood
N Aniceto, AA Freitas, A Bender, T Ghafourian
Journal of Cheminformatics
(2016)
8
Electronic absorption spectra of pyridine and nicotine in aqueous solution with a combined molecular dynamics and polarizable QM/MM approach
M Pagliai, G Mancini, I Carnimeo, N De Mitri, V Barone
Journal of computational chemistry
(2016)
38
Ice formation on kaolinite: Insights from molecular dynamics simulations
GC Sosso, GA Tribello, A Zen, P Pedevilla, A Michaelides
The Journal of Chemical Physics
(2016)
145
Probing helical transitions in a DNA duplex†
DJ Wales, D Chakraborty
Physical Chemistry Chemical Physics
(2016)
Parameterization of Water Electrooxidation Catalyzed by Metal Oxides Using Fourier Transformed Alternating Current Voltammetry
SA Bonke, AM Bond, L Spiccia, AN Simonov
J Am Chem Soc
(2016)
138
One-Pot Synthesis of Amino Acid-Based Polyelectrolytes and Nanoparticle Synthesis.
S Mommer, H Keul, M Möller
Biomacromolecules
(2016)
18
Use of optoelectronic tweezers in manufacturing-accurate solder bead positioning
S Zhang, Y Liu, J Juvert, P Tian, J-C Navarro, JM Cooper, SL Neale
Applied Physics Letters
(2016)
109
A randomized control trial evaluating fluorescent ink $\textit{versus}$ dark ink tattoos for breast radiotherapy
SJ Landeg, AM Kirby, SF Lee, F Bartlett, K Titmarsh, E Donovan, CL Griffin, L Gothard, I Locke, HA McNair
British Journal of Radiology
(2016)
89
Bayesian Analysis of Continuous Time Markov Chains with Application to Phylogenetic Modelling
T Zhao, Z Wang, A Cumberworth, J Gsponer, N de Freitas, A Bouchard-Côté
Bayesian Analysis
(2016)
11