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  • Currently displaying 9361 - 9380 of 29614 publications
Author(s)
Publication title
Journal Name
Publication year
Coarse-Grained Simulations Complemented by Atomistic Molecular Dynamics Provide New Insights into Folding and Unfolding of Human Telomeric G-Quadruplexes.
P Stadlbauer, L Mazzanti, T Cragnolini, DJ Wales, P Derreumaux, S Pasquali, J Šponer
J Chem Theory Comput
(2016)
12
Heterogeneous reaction of ClONO$_{2}$ with TiO$_{2}$ and SiO$_{2}$ aerosol particles: implications for stratospheric particle injection for climate engineering
M Tang, J Keeble, P Telford, FD Pope, P Braesicke, PT Griffiths, NL Abraham1, J McGregor, IM Watson, RA Cox, JA Pyle, M Kalberer
Atmospheric Chemistry and Physics
(2016)
16
An iron-catalysed C-C bond-forming spirocyclization cascade providing sustainable access to new 3D heterocyclic frameworks.
K Adams, AK Ball, J Birkett, L Brown, B Chappell, DM Gill, PKT Lo, NJ Patmore, CR Rice, J Ryan, P Raubo, JB Sweeney
Nature chemistry
(2016)
9
Effects of Nanoscale Heterogeneities on the Reactivity of Shocked Erythritol Tetranitrate
D Furman, R Kosloff, Y Zeiri
The Journal of Physical Chemistry C
(2016)
120
Constraints on oceanic methane emissions west of Svalbard from atmospheric in situ measurements and Lagrangian transport modeling.
I Pisso, CL Myhre, SM Platt, S Eckhardt, O Hermansen, N Schmidbauer, J Mienert, S Vadakkepuliyambatta, S Bauguitte, J Pitt, G Allen, KN Bower, S O'Shea, MW Gallagher, CJ Percival, J Pyle, M Cain, A Stohl
Journal of geophysical research. Atmospheres : JGR
(2016)
121
Proximity-Induced H‑Aggregation of Cyanine Dyes on DNA-Duplexes
F Nicoli, MK Roos, EA Hemmig, M Di Antonio, R de Vivie-Riedle, T Liedl
J Phys Chem A
(2016)
120
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 Discussions
(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
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
(2016)
355
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
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 : the ACS journal of surfaces and colloids
(2016)
32
Multi-dimensional super-resolution imaging enables surface hydrophobicity mapping.
MN Bongiovanni, J Godet, MH Horrocks, L Tosatto, AR Carr, DC Wirthensohn, RT Ranasinghe, JV Fritz, CM Dobson, D Klenerman, SF Lee
Nat Commun
(2016)
7
Preface: Special Topic on Nucleation: New Concepts and Discoveries
KF Kelton, D Frenkel
The Journal of chemical physics
(2016)
145
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
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
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
Biophys J
(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
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