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  • Currently displaying 12821 - 12840 of 29680 publications
Author(s)
Publication title
Journal Name
Publication year
International chemical identifier for reactions (RInChI) Dr Antony Williams
G Grethe, JM Goodman, CH Allen
J Cheminform
(2013)
5
Broadband photoresponse and rectification of novel graphene oxide/n-Si heterojunctions
R Maiti, S Manna, A Midya, SK Ray
Optics Express
(2013)
21
Representing ozone extremes in European megacities: the importance of resolution in a global chemistry climate model
ZS Stock, MR Russo, JA Pyle
(2013)
Experimental Confirmation of New Drug-Target Interactions Predicted by Drug Profile Matching
L Végner, Á Peragovics, L Tombor, B Jelinek, P Czobor, A Bender, Z Simon, A Málnási-Csizmadia
J Med Chem
(2013)
56
Rough passage across a barrier
B Schuler, J Clarke
Nature
(2013)
502
Cyclic peptides
SR Adusumalli, AK Yudin, V Rai
(2013)
Cooperative effects in FH/Li⋯HCCX⋯OH2 complexes (X=F, Cl, Br, H)
SAC McDowell, AD Buckingham
Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy
(2013)
136
Lattice model of mobility at interfaces: free surfaces, substrates, and bilayers
NB Tito, JEG Lipson, ST Milner
Soft Matter
(2013)
9
Complex 5d Magnetism in a Novel S = 1/2 Trimer System, the 12L Hexagonal Perovskite Ba4BiIr3O12
W Miiller, MT Dunstan, Z Huang, Z Mohamed, BJ Kennedy, M Avdeev, CD Ling
Inorganic chemistry
(2013)
52
Structures of cefradine dihydrate and cefaclor dihydrate from DFT-D calculations.
J van de Streek, J Rantanen, AD Bond
Acta Crystallogr C
(2013)
69
Enantio­tropically related polymorphs of gaboxadol hydro­chloride
H Lopez de Diego, V Koradia, AD Bond
Acta Crystallogr C
(2013)
69
Nanostructure determination from the pair distribution function: a parametric study of the INVERT approach.
MJ Cliffe, AL Goodwin
Journal of Physics Condensed Matter
(2013)
25
Fluorescent lifetime imaging of atmospheric aerosols: A direct probe of aerosol viscosity
NA Hosny, C Fitzgerald, C Tong, M Kalberer, MK Kuimova, FD Pope
Faraday Discussions
(2013)
165
Regional and global impacts of Criegee intermediates on atmospheric sulphuric acid concentrations and first steps of aerosol formation.
CJ Percival, O Welz, AJ Eskola, JD Savee, DL Osborn, DO Topping, D Lowe, SR Utembe, A Bacak, G McFiggans, MC Cooke, P Xiao, AT Archibald, ME Jenkin, RG Derwent, I Riipinen, DWK Mok, EPF Lee, JM Dyke, CA Taatjes, DE Shallcross
Faraday discussions
(2013)
165
Extensions to In Silico Bioactivity Predictions Using Pathway Annotations and Differential Pharmacology Analysis: Application to Xenopus laevis Phenotypic Readouts
S Liggi, G Drakakis, AE Hendry, KM Hanson, SC Brewerton, GN Wheeler, MJ Bodkin, DA Evans, A Bender
Mol Inform
(2013)
32
Direct band gap optical emission from compressively strained Ge films grown on relaxed Si0.5Ge0.5 substrate
R Aluguri, S Manna, SK Ray
Applied Physics Letters
(2013)
103
Concise copper-catalyzed synthesis of tricyclic biaryl ether-linked aza-heterocyclic ring systems.
P Mestichelli, MJ Scott, WRJD Galloway, J Selwyn, JS Parker, DR Spring
Organic Letters
(2013)
15
Postclustering dynamic covalent modification for chirality control and chiral sensing.
Y Yang, X-L Pei, Q-M Wang
Journal of the American Chemical Society
(2013)
135
On the accuracy of van der Waals inclusive density-functional theory exchange-correlation functionals for ice at ambient and high pressures
B Santra, J Klimes, A Tkatchenko, D Alfè, B Slater, A Michaelides, R Car, M Scheffler
The Journal of chemical physics
(2013)
139
Combining Solvent Thermodynamic Profiles with Functionality Maps of the Hsp90 Binding Site to Predict the Displacement of Water Molecules
K Haider, DJ Huggins
Journal of Chemical Information and Modeling
(2013)
53