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  • Currently displaying 9741 - 9760 of 30170 publications
Author(s)
Publication title
Journal Name
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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
The Nature of the Mechanical Bond. From Molecules to Machines Von Carson J. Bruns und J. Fraser Stoddart.
JR Nitschke
Angewandte Chemie
(2016)
129
The Nature of the Mechanical Bond. From Molecules to Machines By Carson J. Bruns and J. Fraser Stoddart.
JR Nitschke
Angewandte Chemie - International Edition
(2016)
56
Active sites in heterogeneous ice nucleation-the example of K-rich feldspars.
A Kiselev, F Bachmann, P Pedevilla, SJ Cox, A Michaelides, D Gerthsen, T Leisner
Science (New York, N.Y.)
(2016)
355
Rapid Self-Assembly of Block Copolymers for Flower-Like Particles with High Throughput
Z Wang, Y Cao, X Zhang, D Wang, M Liu, Z Xie, Y Wang
Langmuir
(2016)
32
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 Biol
(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
Journal of Chemical Physics
(2016)
145
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 J Nanotechnol
(2016)
7
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
Evidence for stable square ice from quantum Monte Carlo
J Chen, A Zen, JG Brandenburg, D Alfè, A Michaelides
Physical Review B
(2016)
94
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
Parameterization of Water Electrooxidation Catalyzed by Metal Oxides Using Fourier Transformed Alternating Current Voltammetry.
SA Bonke, AM Bond, L Spiccia, AN Simonov
Journal of the American Chemical Society
(2016)
138
Probing helical transitions in a DNA duplex†
DJ Wales, D Chakraborty
Physical Chemistry Chemical Physics
(2016)
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
Ice formation on kaolinite: Insights from molecular dynamics simulations.
GC Sosso, GA Tribello, A Zen, P Pedevilla, A Michaelides
Journal of Chemical Physics
(2016)
145
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
J Comput Chem
(2016)
38