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  • Currently displaying 13561 - 13580 of 29280 publications
Author(s)
Publication title
Journal Name
Publication year
Sequence-based prediction of protein solubility
F Agostini, M Vendruscolo, GG Tartaglia
Journal of Molecular Biology
(2012)
421
Chaotic dynamics near steep transition states
JR Green, TS Hofer, DJ Wales, RS Berry
Molecular Physics
(2012)
110
Structural basis for efficient chromophore communication and energy transfer in a constructed didomain protein scaffold.
JAJ Arpino, H Czapinska, A Piasecka, WR Edwards, P Barker, MJ Gajda, M Bochtler, DD Jones
J Am Chem Soc
(2012)
134
Toward a trace-free oxidant—insight into unexpected high yields of vapor phase polymerized polyterthiophene
C Ong, PM Bayley, O Winther-Jensen, B Winther-Jensen
Polymer Journal
(2012)
45
A synthesis of the pseudopterosin A-F aglycone
J Cooksey, P Kocieński, A Schmidt, T Snaddon, C Kilner
Synthesis
(2012)
44
Complementing high-throughput X-ray powder diffraction data with quantum-chemical calculations: Application to piroxicam form III.
K Naelapää, J van de Streek, J Rantanen, AD Bond
J Pharm Sci
(2012)
101
The Silicides M4Si4 with M = Na, K, Rb, Cs, and Ba2Si4 – NMR Spectroscopy and Quantum Mechanical Calculations
T Goebel, A Ormeci, O Pecher, F Haarmann
Zeitschrift für anorganische und allgemeine Chemie
(2012)
638
A total synthesis of the ammonium ionophore, (-)-enniatin B
DX Hu, M Bielitza, P Koos, SV Ley
Tetrahedron Letters
(2012)
53
Smoothing of the GB1 Hairpin Folding Landscape by Interfacial Confinement
A Bhattacharya, RB Best, J Mittal
Biophys J
(2012)
103
Halide Anions as Shape-Directing Agents for Obtaining High-Quality Anisotropic Gold Nanostructures
JS DuChene, W Niu, JM Abendroth, Q Sun, W Zhao, F Huo, WD Wei
Chemistry of Materials
(2012)
25
Solution and Solid-State Supramolecular Chemistry of Naphthalenediimides
GD Pantos, JKM Sanders
Acta Crystallographica Section A Foundations of Crystallography
(2012)
68
The semantics of Chemical Markup Language (CML) for computational chemistry : CompChem.
W Phadungsukanan, M Kraft, JA Townsend, P Murray-Rust
J Cheminform
(2012)
4
Discovery of novel allosteric inhibitors of HCV NS3/4a enzyme via structure-based drug design
P Pathuri, SM Saalau-Bethell, AJ Woodhead, MG Carr, G Chessari, J Coyle, M Frederickson, B Graham, C Hamlett, SD Hiscock, FP Holding, H Jhoti, R McMenamin, CW Murray, M Reader, DC Rees, SJ Rich, CJ Richardson, N Thompson, ML Verdonk, M Vinkovic, PA Williams, J Yon
Acta Crystallographica Section A: Foundations and advances
(2012)
68
Four-site cooperative spin crossover in polymorphs of a mononuclear FeII complex
AD Bond, A Lennartson, S Piligkos, CJ McKenzie
Acta Crystallographica Section A: Foundations and advances
(2012)
68
A novel approach to crystal structure determination for organic compounds
MD Eddleston, KE Hejczyk, EG Bithell, GM Day, W Jones
Acta Crystallographica Section A Foundations of Crystallography
(2012)
68
ADP ribosylation adapts an ER chaperone response to short-term fluctuations in unfolded protein load
JE Chambers, K Petrova, G Tomba, M Vendruscolo, D Ron
The Journal of cell biology
(2012)
198
Optimization of the Additive CHARMM All-Atom Protein Force Field Targeting Improved Sampling of the Backbone ϕ, ψ and Side-Chain χ1 and χ2 Dihedral Angles
RB Best, X Zhu, J Shim, PEM Lopes, J Mittal, M Feig, AD Mackerell
Journal of Chemical Theory and Computation
(2012)
8
Fabrication of Microgel Particles with Complex Shape via Selective Polymerization of Aqueous Two-Phase Systems
S Ma, J Thiele, X Liu, Y Bai, C Abell, WTS Huck
Small
(2012)
8
First-order rate-determining aggregation mechanism of p53 and its implications
G Wang, AR Fersht
Proceedings of the National Academy of Sciences of the United States of America
(2012)
109
Kinetic mechanism of p53 oncogenic mutant aggregation and its inhibition.
R Wilcken, G Wang, FM Boeckler, AR Fersht
Proceedings of the National Academy of Sciences of the United States of America
(2012)
109