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  • Currently displaying 14101 - 14120 of 30298 publications
Author(s)
Publication title
Journal Name
Publication year
Vibrational Sum Frequency Generation Spectroscopy of the Water Liquid–Vapor Interface from Density Functional Theory-Based Molecular Dynamics Simulations
M Sulpizi, M Salanne, M Sprik, M-P Gaigeot
The journal of physical chemistry letters
(2012)
4
Ratcheted molecular-dynamics simulations identify efficiently the transition state of protein folding.
G Tiana, C Camilloni
The Journal of chemical physics
(2012)
137
The simulation approach to lipid-protein interactions.
T Paramo, D Garzón, DA Holdbrook, S Khalid, PJ Bond
Methods in Molecular Biology
(2012)
974
Preconditioning of microglia with Parkinson-linked alpha-synuclein affects the response induced by Toll-like receptor (TLR) stimulation
C Roodveldt, A Labrador-Garrido, E Gonzalez-Rey, CC Lachaud, T Guilliams, R Fernandez-Montesinos, A Hmadcha, M Delgado, CM Dobson, D Pozo
JOURNAL OF NEUROIMMUNOLOGY
(2012)
253
The Relationship between Aggregation and Toxicity of Polyglutamine-Containing Ataxin-3 in the Intracellular Environment of Escherichia coli
G Invernizzi, FA Aprile, A Natalello, A Ghisleni, A Penco, A Relini, SM Doglia, P Tortora, ME Regonesi
PLoS ONE
(2012)
7
Water Evaporation: A Transition Path Sampling Study
P Varilly, D Chandler
The Journal of Physical Chemistry Part B: Condensed Matter, Materials, Surfaces, Interfaces and Biophysical
(2012)
117
Ubiquitin chain conformation regulates recognition and activity of interacting proteins
Y Ye
Nature
(2012)
492
Climatic impact of the long‐lasting 1783 Laki eruption: Inapplicability of mass‐independent sulfur isotopic composition measurements
A Schmidt, T Thordarson, LD Oman, A Robock, S Self
Journal of Geophysical Research
(2012)
117
Transformations within a Network of Cadmium Architectures
W Meng, TK Ronson, JK Clegg, JR Nitschke
Angewandte Chemie
(2012)
125
An Acetylene-Bridged 6,8-Purine Dimer as a Fluorescent Switch-On Probe for Parallel G-Quadruplexes
M Nikan, M Di Antonio, K Abecassis, K McLuckie, S Balasubramanian
Angew Chem Int Ed Engl
(2012)
52
Transformations within a network of cadmium architectures.
W Meng, TK Ronson, JK Clegg, JR Nitschke
Angew Chem Int Ed Engl
(2012)
52
Gold nanoparticles produced in situ mediate bioelectricity and hydrogen production in a microbial fuel cell by quantized capacitance charging
S Kalathil, J Lee, MH Cho
Chemsuschem
(2012)
6
Covalent α-Synuclein Dimers: Chemico-Physical and Aggregation Properties
M Pivato, G De Franceschi, L Tosatto, E Frare, D Kumar, D Aioanei, M Brucale, I Tessari, M Bisaglia, B Samori, PP de Laureto, L Bubacco
PLoS ONE
(2012)
7
Layering, freezing and re-entrant melting of hard spheres in soft confinement
T Curk, A de Hoogh, FJ Martinez-Veracoechea, E Eiser, D Frenkel, J Dobnikar, ME Leunissen
(2012)
Role of structure and interfaces in the performance of TiSnSb as an electrode for Li-ion batteries
C Marino, MT Sougrati, B Gerke, R Pöttgen, H Huo, M Ménétrier, CP Grey, L Monconduit
Chemistry of Materials
(2012)
24
The phase of iron catalyst nanoparticles during carbon nanotube growth
CT Wirth, BC Bayer, AD Gamalski, S Esconjauregui, RS Weatherup, C Ducati, C Baehtz, J Robertson, S Hofmann
Chemistry of Materials
(2012)
24
Relationship Between Molecular Contact Thermodynamics and Surface Contact Mechanics
N Nikogeorgos, CA Hunter, GJ Leggett
Langmuir
(2012)
28
Highlights from the 47th EUCHEM conference on stereochemistry, Bürgenstock, Switzerland, May 2012
TD Sheppard, TN Snaddon
Chem Commun (Camb)
(2012)
48
The surface plasmon modes of self-assembled gold nanocrystals
SJ Barrow, X Wei, JS Baldauf, AM Funston, P Mulvaney
Nature communications
(2012)
3
Synthesis of Differentially Substituted 1,2-Diamines through Advances in C–H Amination Technology
DE Olson, DA Roberts, J Du Bois
Organic Letters
(2012)
14