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  • Currently displaying 14001 - 14020 of 30861 publications
Author(s)
Publication title
Journal Name
Publication year
Full "laplacianised" posterior naive Bayesian algorithm
HY Mussa, JBO Mitchell, RC Glen
Journal of Cheminformatics
(2013)
5
Diversity Selection of Compounds Based on ‘Protein Affinity Fingerprints’ Improves Sampling of Bioactive Chemical Space
HP Nguyen, A Koutsoukas, F Mohd Fauzi, G Drakakis, M Maciejewski, RC Glen, A Bender
Chemical Biology and Drug Design
(2013)
82
A left-handed building block self-assembles into right-and left-handed helices
SW Olesen, SN Fejer, D Chakrabarti, DJ Wales
Rsc Advances
(2013)
3
Crystal architecture and physicochemical properties of felodipine solvates
AO Surov, KA Solanko, AD Bond, A Bauer-Brandl, GL Perlovich
Crystengcomm
(2013)
15
Inelastic scattering of OH radicals from organic liquids: isolating the thermal desorption channel
KL King, G Paterson, GE Rossi, M Iljina, RE Westacott, ML Costen, KG McKendrick
Phys Chem Chem Phys
(2013)
15
η2-Allenyl- and η2-Alkynylphosphonium Complexes of Platinum
AL Colebatch, IA Cade, AF Hill, MM Bhadbhade
Organometallics
(2013)
32
Relationship between chemical structure and supramolecular effective molarity for formation of intramolecular H-bonds
H Sun, CA Hunter, C Navarro, S Turega
Journal of the American Chemical Society
(2013)
135
Advantages of mechanochemical cocrystallisation in the solid-state chemistry of pigments: colour-tuned fluorescein cocrystals
D-K Bučar, S Filip, M Arhangelskis, GO Lloyd, W Jones
CrystEngComm
(2013)
15
An Electronically Non-Adiabatic Generalization of Ring Polymer Molecular Dynamics
TJH Hele
(2013)
Metalloenzymes: Cutting out the middleman.
S Roy, AK Jones
Nature chemical biology
(2013)
9
Sub-ångström-resolution crystallography reveals physical distortions that enhance reactivity of a covalent enzymatic intermediate.
S Lüdtke, P Neumann, KM Erixon, F Leeper, R Kluger, R Ficner, K Tittmann
Nature chemistry
(2013)
5
Graphical Interfaces and Virtual Reality for Molecular Sciences
A Salvadori, D Licari, G Mancini, A Brogni, N De Mitri, V Barone
(2013)
T2 distribution spectra obtained by continuum fitting method using a mixed Gaussian and exponential kernel function
H Zhu, HP Huinink, PCMM Magusin, OCG Adan, K Kopinga
J Magn Reson
(2013)
235
The effects of buffers and pH on the thermal stability, unfolding and substrate binding of RecA.
MA Metrick, JE Temple, G MacDonald
Biophys Chem
(2013)
184
Use of In Situ Atomic Force Microscopy to Follow Phase Changes at Crystal Surfaces in Real Time
R Thakuria, MD Eddleston, EHH Chow, GO Lloyd, BJ Aldous, JF Krzyzaniak, AD Bond, W Jones
Angewandte Chemie
(2013)
125
Use of In Situ Atomic Force Microscopy to Follow Phase Changes at Crystal Surfaces in Real Time
R Thakuria, MD Eddleston, EHH Chow, GO Lloyd, BJ Aldous, JF Krzyzaniak, AD Bond, W Jones
Angew Chem Int Ed Engl
(2013)
52
Light-mediated in cell downregulation of G-quadruplex-containing genes using a photo-caged ligand
P Murat, MV Gormally, D Sanders, M Di Antonio, S Balasubramanian
Chemical communications (Cambridge, England)
(2013)
49
In situ observations of the atomistic mechanisms of Ni catalyzed low temperature graphene growth
LL Patera, C Africh, RS Weatherup, R Blume, S Bhardwaj, C Castellarin-Cudia, A Knop-Gericke, R Schloegl, G Comelli, S Hofmann, C Cepek
ACS nano
(2013)
7
Solution structures and acidity constants of molybdic acid
X Liu, J Cheng, M Sprik, X Lu
Journal of Physical Chemistry Letters
(2013)
4
Remarkably fast coupled folding and binding of the intrinsically disordered transactivation domain of cMyb to CBP KIX
SL Shammas, AJ Travis, J Clarke
J Phys Chem B
(2013)
117