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  • Currently displaying 13261 - 13280 of 29634 publications
Author(s)
Publication title
Journal Name
Publication year
Ligand-Directed Control over Crystal Structures of InorganicOrganic Frameworks and Formation of Solid Solutions
HH-M Yeung, W Li, PJ Saines, TKJ Köster, CP Grey, AK Cheetham
Angew Chem Int Ed Engl
(2013)
52
Reply to Campos and Muñoz: Why phosphate is a bad buffer for guanidinium chloride titrations
AR Fersht, M Petrovich
Proceedings of the National Academy of Sciences
(2013)
110
Hydrodynamic comparison of the Penumbra system and commonly available syringes in forced-suction thrombectomy.
SD Simon, CP Grey
Journal of NeuroInterventional Surgery
(2013)
6
Diverse topologies in dynamic combinatorial libraries from tri- and mono-thiols in water : sensitivity to weak supramolecular interactions
AR Stefankiewicz, JKM Sanders
Chemical Communications
(2013)
49
Structural insights into the formation and evolution of amorphous phase-change materials
JM Skelton, D Loke, TH Lee, SR Elliott
Physica Status Solidi B Basic Research
(2013)
250
Revised classification of kinases based on bioactivity data: the importance of data density and choice of visualization
S Paricharak, T Klenka, M Augustin, UA Patel, A Bender
Journal of Cheminformatics
(2013)
5
Quantifying the shifts in physicochemical property space introduced by the metabolism of small organic molecules
J Kirchmair, A Howlett, J Peironcely, DS Murrell, M Williamson, SE Adams, T Hankemeier, L van Buren, G Duchateau, W Klaffke, RC Glen
Journal of Cheminformatics
(2013)
5
International chemical identifier for chemical reactions
G Grethe, J Goodman, C Allen
Journal of Cheminformatics
(2013)
5
Annotating targets with pathways: extending approaches to mode of action analysis
S Liggi, A Koutsoukas, YK Motamedi, RC Glen, A Bender
Journal of cheminformatics
(2013)
5
Chemogenomics approaches to rationalising compound action of traditional Chinese and Ayurvedic medicines
FM Fauzi, A Koutsoukas, R Lowe, K Joshi, T-P Fan, A Bender
Journal of Cheminformatics
(2013)
5
Using machine learning techniques for rationalising phenotypic readouts from a rat sleeping model
G Drakakis, A Koutsoukas, SC Brewerton, DD Evans, A Bender
Journal of Cheminformatics
(2013)
5
Experimental validation of in silico target predictions on synergistic protein targets
I Cortes-Ciriano, A Koutsoukas, O Abian, A Bender, A Velazquez-Campoy
Journal of Cheminformatics
(2013)
5
In silico target prediction: identification of on- and off-targets for crop protection agents
RK Chiddarwar, A Bender, S Rohrer
Journal of Cheminformatics
(2013)
5
Relating GPCRs pharmacological space based on ligands chemical similarities
A Koutsoukas, R Torella, G Drakakis, A Bender, RC Glen
Journal of Cheminformatics
(2013)
5
Single-crystal adsorption calorimetry and density functional theory of CO chemisorption on fcc Co{110}.
K Liao, V Fiorin, DSD Gunn, SJ Jenkins, DA King
Physical Chemistry Chemical Physics
(2013)
15
Insights into chromatin fibre structure by in vitro and in silico single-molecule stretching experiments
R Collepardo-Guevara, T Schlick
Biochemical Society Transactions
(2013)
41
Lattice model of dynamic heterogeneity and kinetic arrest in glass-forming liquids
NB Tito, JEG Lipson, ST Milner
Soft Matter
(2013)
9
Symmetrisation schemes for global optimisation of atomic clusters.
MT Oakley, RL Johnston, DJ Wales
Phys Chem Chem Phys
(2013)
15
JOYCE and ULYSSES: integrated and user-friendly tools for the parameterization of intramolecular force fields from quantum mechanical data
V Barone, I Cacelli, N De Mitri, D Licari, S Monti, G Prampolini
Phys Chem Chem Phys
(2013)
15
Synthesis of magnetic rattle-type nanostructures for use in water treatment.
S Linley, T Leshuk, FX Gu
ACS Applied Materials & Interfaces
(2013)
5