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  • Currently displaying 10241 - 10260 of 29233 publications
Author(s)
Publication title
Journal Name
Publication year
$\textit{Ab initio}$ study of phosphorus anodes for lithium and sodium-ion batteries
M Mayo, KJ Griffith, CJ Pickard, AJ Morris
(2015)
Stability of Complex Biomolecular Structures: van der Waals, Hydrogen Bond Cooperativity, and Nuclear Quantum Effects.
M Rossi, W Fang, A Michaelides
The Journal of Physical Chemistry Letters
(2015)
6
Determination of Thermal Expansion Coefficients and Locating the Temperature-Induced Phase Transition in Methylammonium Lead Perovskites Using X-ray Diffraction
TJ Jacobsson, LJ Schwan, M Ottosson, A Hagfeldt, T Edvinsson
Inorg Chem
(2015)
54
Reductive Hydrogenation of the Aqueous Rutile TiO2(110) Surface
J Cheng, X Liu, J VandeVondele, M Sprik
Electrochimica Acta
(2015)
179
Latent analysis of unmodified biomolecules and their complexes in solution with attomole detection sensitivity.
EV Yates, T Müller, L Rajah, EJ De Genst, P Arosio, S Linse, M Vendruscolo, CM Dobson, TPJ Knowles
Nature chemistry
(2015)
7
Direct UV-written planar Bragg grating sensors
C Holmes, JC Gates, LG Carpenter, HL Rogers, RM Parker, PA Cooper, FRM Adikan, CBE Gawith, PGR Smith, S Chaotan
Measurement Science and Technology
(2015)
26
Review-Manganese-Based P2-Type Transition Metal Oxides as Sodium-Ion Battery Cathode Materials
RJ Clément, PG Bruce, CP Grey
Journal of The Electrochemical Society
(2015)
162
Efficient Sampling of High-Dimensional Free-Energy Landscapes with Parallel Bias Metadynamics
J Pfaendtner, M Bonomi
J Chem Theory Comput
(2015)
11
Jean-Pierre Hansen - A stimulating history of simulating fluids
B Rotenberg, G Jackson, D Frenkel
Molecular Physics
(2015)
113
Plasticity of an ultrafast interaction between nucleoporins and nuclear transport receptors.
S Milles, D Mercadante, IV Aramburu, MR Jensen, N Banterle, C Koehler, S Tyagi, J Clarke, SL Shammas, M Blackledge, F Gräter, EA Lemke
Cell
(2015)
163
Nanoscale structure of microvoids in a-Si:H: a first-principles study
P Biswas, SR Elliott
Journal of physics. Condensed matter : an Institute of Physics journal
(2015)
27
Ligand Discovery for the Alanine-Serine-Cysteine Transporter (ASCT2, SLC1A5) from Homology Modeling and Virtual Screening
C Colas, C Grewer, NJ Otte, A Gameiro, T Albers, K Singh, H Shere, M Bonomi, J Holst, A Schlessinger
PLoS computational biology
(2015)
11
An excited-state approach within full configuration interaction quantum Monte Carlo.
NS Blunt, SD Smart, GH Booth, A Alavi
The Journal of Chemical Physics
(2015)
143
Formation of oligopeptides in high yield under simple programmable conditions.
M Rodriguez-Garcia, AJ Surman, GJT Cooper, I Suárez-Marina, Z Hosni, MP Lee, L Cronin
Nat Commun
(2015)
6
An Autocatalytic System of Photooxidation‐Driven Substitution Reactions on a FeII4L6 Cage Framework
PP Neelakandan, A Jiménez, JD Thoburn, JR Nitschke
Angewandte Chemie
(2015)
127
An Autocatalytic System of Photooxidation-Driven Substitution Reactions on a FeII4L6 Cage Framework
PP Neelakandan, A Jiménez, JD Thoburn, JR Nitschke
Angew Chem Int Ed Engl
(2015)
54
Competition between ices Ih and Ic in homogeneous water freezing
A Zaragoza, MM Conde, JR Espinosa, C Valeriani, C Vega, E Sanz
J Chem Phys
(2015)
143
Luminescent (N^C^C) Gold(III) Complexes: Stabilized Gold(III) Fluorides.
R Kumar, A Linden, C Nevado
Angewandte Chemie (International ed. in English)
(2015)
54
Chaperome screening leads to identification of Grp94/Gp96 and FKBP4/52 as modulators of the α‐synuclein‐elicited immune response
A Labrador-Garrido, M Cejudo-Guillén, S Daturpalli, MM Leal, R Klippstein, EJ De Genst, J Villadiego, JJ Toledo-Aral, CM Dobson, SE Jackson, D Pozo, C Roodveldt
FASEB journal : official publication of the Federation of American Societies for Experimental Biology
(2015)
30
Thermodynamic Analysis of Allosteric and Chelate Cooperativity in Di- and Trivalent Ammonium/Crown-Ether Pseudorotaxanes
K Nowosinski, LKS von Krbek, NL Traulsen, CA Schalley
Org Lett
(2015)
17