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  • Currently displaying 13141 - 13160 of 30214 publications
Author(s)
Publication title
Journal Name
Publication year
Tunable microstructured surface-enhanced Raman scattering substrates via electrohydrodynamic lithography
S Mahajan, T Hutter, U Steiner, PG Oppenheimer
The Journal of Physical Chemistry Letters
(2013)
4
Double-ended surface walking method for pathway building and transition state location of complex reactions
X-J Zhang, C Shang, Z-P Liu
Journal of chemical theory and computation
(2013)
9
CuInxGa1-xSe2 as an efficient photocathode for solar hydrogen generation
TJ Jacobsson, C Platzer-Björkman, M Edoff, T Edvinsson
International Journal of Hydrogen Energy
(2013)
38
Hapten design for antibody-catalyzed decarboxylation and ring-opening reactions of benzisoxazoles
MV Sergeeva, V Yomtova, A Parkinson, M Overgaauw, R Pomp, A Schots, AJ Kirby, R Hilhorst
Israel Journal of Chemistry
(2013)
36
Fine Structure in NMR Correlation Spectroscopy
R Freeman, L Mcintyre
Israel Journal of Chemistry
(2013)
32
ANALYTIC 2ND DERIVATIVES OF THE POTENTIAL-ENERGY SURFACE
NC Handy, DJ Tozer, GJ Laming, CW Murray, RD Amos
Israel Journal of Chemistry
(2013)
33
Approaches to Antibody‐Catalyzed Cationic Cyclizations: Chemical Studies of Leaving Groups and Cyclization Modes
C Lawrence, IM Bell, C Abell, FJ Leeper
Israel Journal of Chemistry
(2013)
36
Understanding the connection between epigenetic DNA methylation and nucleosome positioning from computer simulations.
G Portella, F Battistini, M Orozco
PLoS Comput Biol
(2013)
9
Reversal of facial selectivity in a thia-Claisen rearrangement by incorporation of a vinylic bromine substituent.
AR Ellwood, AJP Mortimer, JM Goodman, MJ Porter
Organic & Biomolecular Chemistry
(2013)
11
Replica-averaged metadynamics
C Camilloni, A Cavalli, M Vendruscolo
Journal of chemical theory and computation
(2013)
9
Potential energy landscapes for the 2D XY model: Minima, transition states, and pathways
D Mehta, C Hughes, M Schröck, DJ Wales
Journal of Chemical Physics
(2013)
139
Bone mineralization: Water brings order.
M Duer, A Veis
Nat Mater
(2013)
12
Combined diffraction and density functional theory calculations of halogen-bonded cocrystal monolayers.
M Sacchi, AY Brewer, SJ Jenkins, JE Parker, T Friščić, SM Clarke
Langmuir
(2013)
29
Topotactic and Topochemical Conversions of Distyrylpyrazine
H Nakanishi, GM Parkinson, W Jones, JM Thomas, M Hasegawa
Israel Journal of Chemistry
(2013)
18
Hydrolysis of Tetraglycine by a Zr(IV)-Substituted Wells-Dawson Polyoxotungstate Studied by Diffusion Ordered NMR Spectroscopy
K Stroobants, G Absillis, PS Shestakova, R Willem, TN Parac-Vogt
Journal of Cluster Science
(2013)
25
Analysis of the Rotational–Vibrational States of the Molecular Ion H3+
T Furtenbacher, T Szidarovszky, E Mátyus, C Fábri, AG Császár
J Chem Theory Comput
(2013)
9
Modular isoquinoline synthesis using catalytic enolate arylation and in situ functionalization
BS Pilgrim, AE Gatland, CT McTernan, PA Procopiou, TJ Donohoe
Organic letters
(2013)
15
Light extinction by secondary organic aerosol: An intercomparison of three broadband cavity spectrometers
RM Varma, SM Ball, T Brauers, H-P Dorn, U Heitmann, RL Jones, U Platt, D Pöhler, AA Ruth, AJL Shillings, J Thieser, A Wahner, DS Venables
Atmospheric Measurement Techniques
(2013)
6
Free-energy landscape of protein oligomerization from atomistic simulations
A Barducci, M Bonomi, MK Prakash, M Parrinello
Proceedings of the National Academy of Sciences of the United States of America
(2013)
110
RYB tri-colour electrochromism based on a molecular cobaloxime
MRJ Scherer, NM Muresan, U Steiner, E Reisner
Chem Commun (Camb)
(2013)
49