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Currently displaying 16081 - 16100 of 31132 publications

Proton ordering in cubic ice and hexagonal ice; a potential new ice phase--XIc.

Z Raza, D Alfè, CG Salzmann, J Klimeš, A Michaelides, B Slater

Phys Chem Chem Phys

(2011)

19788

(doi: 10.1039/c1cp22506e)

Light‐Emitting Diodes: Two Distinct Origins of Highly Localized Luminescent Centers within InGaN/GaN Quantum‐Well Light‐Emitting Diodes (Adv. Funct. Mater. 20/2011)

S De, A Layek, A Raja, A Kadir, MR Gokhale, A Bhattacharya, S Dhar, A Chowdhury

Advanced Functional Materials

(2011)

3827

(doi: 10.1002/adfm.201190086)

Deprotonative metalation of chloro- and bromopyridines using amido-based bimetallic species and regioselectivity-computed CH acidity relationships

K Snégaroff, TT Nguyen, N Marquise, YS Halauko, PJ Harford, T Roisnel, VE Matulis, OA Ivashkevich, F Chevallier, AEH Wheatley, PC Gros, F Mongin

Chemistry – A European Journal

(2011)

13284

(doi: 10.1002/chem.201101993)

Phase Diagram of Hard Ellipsoids of Revolution

D Frenkel, BM Mulder, JP Mctague

Molecular Crystals and Liquid Crystals

(2011)

123

119

(doi: 10.1080/00268948508074770)

Probing small molecule binding to amyloid fibrils.

AK Buell, EK Esbjörner, PJ Riss, DA White, FI Aigbirhio, G Toth, ME Welland, CM Dobson, TPJ Knowles

Physical chemistry chemical physics : PCCP

(2011)

20044

(doi: 10.1039/c1cp22283j)

Posttranscriptional chemical functionalization of azide-modified oligoribonucleotides by bioorthogonal click and Staudinger reactions

H Rao, AA Sawant, AA Tanpure, SG Srivatsan

Chem. Commun.

(2011)

498

(doi: 10.1039/c1cc15659d)

Preface

SJ Jenkins

Topics in Catalysis

(2011)

1331

(doi: 10.1007/s11244-011-9767-x)

CMLLite: a design philosophy for CML.

JA Townsend, P Murray-Rust

J Cheminform

(2011)

(doi: 10.1186/1758-2946-3-39)

Open Data, Open Source and Open Standards in chemistry: The Blue Obelisk five years on

NM O'Boyle, R Guha, EL Willighagen, SE Adams, J Alvarsson, J-C Bradley, IV Filippov, RM Hanson, MD Hanwell, GR Hutchison, CA James, N Jeliazkova, AS Lang, KM Langner, DC Lonie, DM Lowe, J Pansanel, D Pavlov, O Spjuth, C Steinbeck, AL Tenderholt, KJ Theisen, P Murray-Rust

Journal of Cheminformatics

(2011)

(doi: 10.1186/1758-2946-3-37)

The Quixote project: Collaborative and Open Quantum Chemistry data management in the Internet age.

S Adams, P de Castro, P Echenique, J Estrada, MD Hanwell, P Murray-Rust, P Sherwood, J Thomas, J Townsend

Journal of cheminformatics

(2011)

(doi: 10.1186/1758-2946-3-38)

Mining chemical information from open patents

DM Jessop, SE Adams, P Murray-Rust

Journal of cheminformatics

(2011)