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Currently displaying 11781 - 11800 of 29877 publications

ALMOST: An all atom molecular simulation toolkit for protein structure determination

B Fu, AB Sahakyan, C Camilloni, GG Tartaglia, E Paci, A Caflisch, M Vendruscolo, A Cavalli

Journal of Computational Chemistry

(2014)

1101

(doi: 10.1002/jcc.23588)

Identification of key residues that confer Rhodobacter sphaeroides LPS activity at horse TLR4/MD-2.

KL Irvine, M Gangloff, CM Walsh, DR Spring, NJ Gay, CE Bryant

Plos One

(2014)

e98776

(doi: 10.1371/journal.pone.0098776)

Direct observation of the three regions in α-synuclein that determine its membrane-bound behaviour.

G Fusco, A De Simone, T Gopinath, V Vostrikov, M Vendruscolo, CM Dobson, G Veglia

Nat Commun

(2014)

3827

(doi: 10.1038/ncomms4827)

Mapping the Internal Recognition Surface of an Octanuclear Coordination Cage Using Guest Libraries

S Turega, W Cullen, M Whitehead, CA Hunter, MD Ward

J Am Chem Soc

(2014)

136

8475

(doi: 10.1021/ja504269m)

Homochiral and meso figure eight knots and a Solomon link.

N Ponnuswamy, FBL Cougnon, GD Pantoş, JKM Sanders

J Am Chem Soc

(2014)

136

8243

(doi: 10.1021/ja4125884)

Exploration of tin-catalyzed phosphine dehydrocoupling: Catalyst effects and observation of tin-catalyzed hydrophosphination

KA Erickson, LSH Dixon, DS Wright, R Waterman

Inorganica Chimica Acta

(2014)

422

141

(doi: 10.1016/j.ica.2014.07.002)

Fukuyama Reduction and Integrated Thioesterification/Fukuyama Reduction of Thioesters and Acyl Chlorides Using Continuous Flow

M Asadi, S Bonke, A Polyzos, DW Lupton

ACS Catalysis

(2014)

2070

(doi: 10.1021/cs5004917)

Palladium-catalysed C–H activation of aliphatic amines to give strained nitrogen heterocycles

A McNally, B Haffemayer, BSL Collins, MJ Gaunt

Nature

(2014)

510

129

(doi: 10.1038/nature13389)

Palladium-catalysed C-H activation of aliphatic amines to give strained nitrogen heterocycles

A McNally, B Haffemayer, BSL Collins, MJ Gaunt

Nature

(2014)

510

129

(doi: 10.1038/nature13389)

A CO2-responsive pillar[5]arene: Synthesis and self-assembly in water

K Jie, Y Yao, X Chi, F Huang

Chem Commun (Camb)

(2014)

5503

(doi: 10.1039/c4cc01704h)

Phase separation in solutions with specific and nonspecific interactions.

WM Jacobs, DW Oxtoby, D Frenkel

J Chem Phys

(2014)

140

204109

(doi: 10.1063/1.4878836)

Cytochrome P450 site of metabolism prediction from 2D topological fingerprints using GPU accelerated probabilistic classifiers.

JD Tyzack, HY Mussa, MJ Williamson, J Kirchmair, RC Glen

J Cheminform

(2014)

(doi: 10.1186/1758-2946-6-29)

Fabrication of crystals from single metal atoms.

NPE Barry, A Pitto-Barry, AM Sanchez, AP Dove, RJ Procter, JJ Soldevila-Barreda, N Kirby, I Hands-Portman, CJ Smith, RK O'Reilly, R Beanland, PJ Sadler

Nature communications

(2014)

3851

(doi: 10.1038/ncomms4851)