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  • Currently displaying 11561 - 11580 of 30598 publications
Author(s)
Publication title
Journal Name
Publication year
Experiments with chemists and information
J Goodman
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2015)
250
Toward an MIE atlas - tools for toxicity prediction
T Allen, S Liggi, J Goodman, S Gutsell, P Russell
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2015)
250
1,5-Antiselective aldol reactions for the total synthesis of the brasilinolides
M Housden, C Cordier, P Burton, F Muehlthau, I Paterson
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2015)
250
Calibration and utility of low-cost and highly-portable gas sensors for atmospheric composition measurement
J Shutter, O Popoola, A Durant, R Freshwater, R Jones
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2015)
250
Which kinase to hit in NCI-60? From a selectivity problem to a multitarget solution
OM Lucio, AC Ravindranath, Q Ul Ain, K Birchall, C Mpamhanga, S Knapp, A Bender
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2015)
250
Fragment-based drug discovery of potent and selective CYP121 inhibitors for tuberculosis
M Kavanagh, A Coyne, G James, K McLean, S Hudson, LP de Carvalho, A Munro, C Abell
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2015)
250
Natural product-inspired fragment-based drug discovery: Development of M. tuberculosis CYP121 inhibitors
M Kavanagh, J Gray, A Coyne, H Davis, K McLean, A Munro, C Abell
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2015)
250
DuBois Photocatalysis: Visible light driven H2 generation with a phosphonated Ni bis(diphosphine) catalyst in water
M Gross, C Caputo, D Wakerley, E Reisner
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2015)
250
Knowledge-based approach to the parameterization of small molecule force fields based on crystal structures
F Roessler, O Korb, R Glen, P Bond
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2015)
250
Computational design and first-in-human studies of a biased (functionally selective) Apelin GPCR agonist
R Glen, A Davenport
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2015)
250
2D ice from first principles: structures and phase transitions
J Chen, G Schusteritsch, CJ Pickard, CG Salzmann, A Michaelides
(2015)
Structure and ionic diffusion of alkaline-earth ions in mixed cation glasses A2O–2MO–4SiO2 with molecular dynamics simulations
K Konstantinou, PV Sushko, DM Duffy
Journal of Non-Crystalline Solids
(2015)
422
Virtual Screening for Transition State Analogue Inhibitors of IRAP Based on Quantum Mechanically Derived Reaction Coordinates.
F Svensson, K Engen, T Lundbäck, M Larhed, C Sköld
Journal of Chemical Information and Modeling
(2015)
55
Mechanistic Insight into the Synthesis of Silica-Based “Matchstick” Colloids
BW Longbottom, LA Rochford, R Beanland, SAF Bon
Langmuir
(2015)
31
Fast Flow Microfluidics and Single-Molecule Fluorescence for the Rapid Characterization of α‑Synuclein Oligomers
MH Horrocks, L Tosatto, AJ Dear, GA Garcia, M Iljina, N Cremades, M Dalla Serra, TPJ Knowles, CM Dobson, D Klenerman
Analytical chemistry
(2015)
87
Mechanistic Insights into the Palladium-Catalyzed Aziridination of Aliphatic Amines by C-H Activation.
AP Smalley, MJ Gaunt
Journal of the American Chemical Society
(2015)
137
Frontal Cryosectioning: An Improved Protocol for Sectioning Large Areas of Fibrous Scaffolds
CP Grey, DG Simpson
Journal of Nanomaterials
(2015)
2015
Tropospheric ozone and its precursors from the urban to the global scale from air quality to short-lived climate forcer
PS Monks, AT Archibald, A Colette, O Cooper, M Coyle, R Derwent, D Fowler, C Granier, KS Law, GE Mills, DS Stevenson, O Tarasova, V Thouret, E von Schneidemesser, R Sommariva, O Wild, ML Williams
Atmospheric Chemistry and Physics
(2015)
15
Ruthenium(II) and osmium(II) vinyl complexes as highly sensitive and selective chromogenic and fluorogenic probes for the sensing of carbon monoxide in air.
A Toscani, C Marín-Hernández, ME Moragues, F Sancenón, P Dingwall, NJ Brown, R Martínez-Máñez, AJP White, JDET Wilton-Ely
Chemistry - A European Journal
(2015)
21
Mapping Structural Changes in Electrode Materials: Application of the Hybrid Eigenvector-Following Density Functional Theory (DFT) Method to Layered Li0.5MnO2
ID Seymour, S Chakraborty, DS Middlemiss, DJ Wales, CP Grey
Chemistry of Materials
(2015)
27