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  • Currently displaying 14661 - 14680 of 31569 publications
Author(s)
Publication title
Journal Name
Publication year
In silico target predictions: Defining a benchmarking data set and comparison of performance of the multiclass Naïve Bayes and Parzen-Rosenblatt Window
A Koutsoukas, R Lowe, Y Kalantarmotamedi, HY Mussa, W Klaffke, JBO Mitchell, RC Glen, A Bender
J Chem Inf Model
(2013)
53
Catalyst‐Controlled Highly Selective Coupling and Oxygenation of Olefins: A Direct Approach to Alcohols, Ketones, and Diketones
Y Su, X Sun, G Wu, N Jiao
Angewandte Chemie (International ed. in English)
(2013)
52
Magnetic and Conducting Properties of Composites of Conducting Polymers and Ferrite Nanoparticles
IM Resta, G Horwitz, MLM Elizalde, GA Jorge, FV Molina, PS Antonel
IEEE Transactions on Magnetics
(2013)
49
Computer-aided (in silico) approaches in the mode-of-action analysis and safety assessment of Ostarine and 4-methylamphetamine
F Mohd Fauzi, A Koutsoukas, A Cunningham, A Gallegos, R Sedefov, A Bender
Human Psychopharmacology
(2013)
28
Energy landscapes and global thermodynamics for alanine peptides
S Somani, DJ Wales
The Journal of Chemical Physics
(2013)
139
Role of methyl-induced polarization in ion binding
M Rossi, A Tkatchenko, SB Rempe, S Varma
Proceedings of the National Academy of Sciences
(2013)
110
Dehydrogenative boron homocoupling of an amine-borane
HC Johnson, CL McMullin, SD Pike, SA Macgregor, AS Weller
Angewandte Chemie (International ed. in English)
(2013)
52
Identification of small-molecule binding pockets in the soluble monomeric form of the Aβ42 peptide.
M Zhu, A De Simone, D Schenk, G Toth, CM Dobson, M Vendruscolo
The Journal of Chemical Physics
(2013)
139
A NOTE ON HIGH ASPECT-RATIO SU-8 MICROMECHANICAL STRUCTURES USING MASK-LESS DIRECT LASER WRITING
S Ghosh, GK Ananthasuresh
ASME 2012 International Manufacturing Science and Engineering Conference
(2013)
Selective inhibition of the unfolded protein response: targeting catalytic sites for Schiff base modification.
SM Tomasio, HP Harding, D Ron, BCS Cross, PJ Bond
Molecular Omics
(2013)
9
Integrated biophysical approach to fragment screening and validation for fragment-based lead discovery
HL Silvestre, TL Blundell, C Abell, A Ciulli
Proceedings of the National Academy of Sciences of the United States of America
(2013)
110
A Single gD Glycoprotein Can Mediate Infection by Herpes simplex Virus
RW Clarke, A Drews, H Browne, D Klenerman
Journal of the American Chemical Society
(2013)
135
High sensitive elemental analysis of single yeast cells (saccharomyces cerevisiae) by time-resolved inductively-coupled plasma mass spectrometry using a high efficiency cell introduction system
AS Groombridge, S-I Miyashita, S-I Fujii, K Nagasawa, T Okahashi, M Ohata, T Umemura, A Takatsu, K Inagaki, K Chiba
Anal Sci
(2013)
29
Accounting for adsorption and desorption in lattice Boltzmann simulations.
M Levesque, M Duvail, I Pagonabarraga, D Frenkel, B Rotenberg
Physical review. E, Statistical, nonlinear, and soft matter physics
(2013)
88
Pharmacokinetic modelling of the anti-malarial drug artesunate and its active metabolite dihydroartemisinin.
AJ Hall, MJ Chappell, JAD Aston, SA Ward
Computer Methods and Programs in Biomedicine
(2013)
112
Alkyl Chain Extension as a Route to Novel Thieno[3,2‑b]thiophene Flanked Diketopyrrolopyrrole Polymers for Use in Organic Solar Cells and Field Effect Transistors
I Meager, RS Ashraf, S Rossbauer, H Bronstein, JE Donaghey, J Marshall, BC Schroeder, M Heeney, TD Anthopoulos, I McCulloch
Macromolecules
(2013)
46
A Self‐Assembled [FeII12L12] Capsule with an Icosahedral Framework
RA Bilbeisi, TK Ronson, JR Nitschke
Angewandte Chemie
(2013)
125
Structure of the Chloride- and Bromide-Intercalated Layered Double Hydroxides of Li and Al - Interplay of Coulombic and Hydrogen-Bonding Interactions in the Interlayer Gallery
S Nagendran, PV Kamath
European Journal of Inorganic Chemistry
(2013)
2013
A geometrical parametrization of C1′-C5′ RNA ribose chemical shifts calculated by density functional theory
R Suardíaz, AB Sahakyan, M Vendruscolo
The Journal of chemical physics
(2013)
139
A case for oxygen deficiency in Gd2Ti2−xZrxO7 pyrochlore-type oxides
JDS Walker, JR Hayes, MW Gaultois, ER Aluri, AP Grosvenor
Journal of Alloys and Compounds
(2013)
565