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  • Currently displaying 18561 - 18580 of 30393 publications
Author(s)
Publication title
Journal Name
Publication year
Engineering Polymer Informatics: Towards the Computer‐Aided Design of Polymers
N Adams, P Murray‐Rust
Macromolecular Rapid Communications
(2008)
29
CrystalEye - From Desktop to Data Repository
OJ Downing, P Murray-Rust, NE Day
http://pubs.or08.ecs.soton.ac.uk/
(2008)
Binding-Induced Folding of a Natively Unstructured Transcription Factor
AG Turjanski, JS Gutkind, RB Best, G Hummer
PLoS Computational Biology
(2008)
4
Distributed Chemical Computing Using ChemStar: An Open Source Java Remote Method Invocation Architecture Applied to Large Scale Molecular Data from PubChem
M Karthikeyan, S Krishnan, AK Pandey, A Bender, A Tropsha
Journal of Chemical Information and Modeling
(2008)
48
Mixing in adsorbed monolayers: Perfluorinated alkanes
JE Parker, SM Clarke
Langmuir
(2008)
24
Automated derivation of structural class symbols and extended Z′ descriptors for molecular crystal structures in the Cambridge Structural Database
AD Bond
CrystEngComm
(2008)
10
Development of Quantitative Cell-Based Enzyme Assays in Microdroplets
A Huebner, LF Olguin, D Bratton, G Whyte, WTS Huck, AJ de Mello, JB Edel, C Abell, F Hollfelder
Anal Chem
(2008)
80
Proton transfer in a polar solvent from ring polymer reaction rate theory
R Collepardo-Guevara, IR Craig, DE Manolopoulos
The Journal of Chemical Physics
(2008)
128
Sensitized detection of inhibitory fragments and iterative development of non-peptidic protease inhibitors by dynamic ligation screening.
MF Schmidt, A Isidro-Llobet, M Lisurek, A El-Dahshan, J Tan, R Hilgenfeld, J Rademann
Angew Chem Int Ed Engl
(2008)
47
Coarse-grained MD simulations of membrane protein-bilayer self-assembly.
KA Scott, PJ Bond, A Ivetac, AP Chetwynd, S Khalid, MSP Sansom
Structure
(2008)
16
Third Virial Coefficient for 4‐Arm and 6‐Arm Star Polymers
S Caracciolo, BM Mognetti, A Pelissetto
Macromolecular Theory and Simulations
(2008)
17
Total synthesis of spirastrellolide A methyl ester - Part 1: Synthesis of an advanced C17-C40 bis-spiroacetal subunit
I Paterson, EA Anderson, SM Dalby, JH Lim, J Genovino, P Maltas, C Moessner
Angewandte Chemie - International Edition
(2008)
47
Total synthesis of spirastrellolide A methyl ester - Part 2: Subunit union and completion of the synthesis
I Paterson, EA Anderson, SM Dalby, JH Lim, J Genovino, P Maltas, C Moessner
Angewandte Chemie - International Edition
(2008)
47
Localization and delocalization errors in density functional theory and implications for band-gap prediction
P Mori-Sánchez, AJ Cohen, W Yang
Physical Review Letters
(2008)
100
PHYS 168-Solvation and reactivity of the aqueous hydroxyl radical
C Adriaanse, M Sulpizi, J VandeVondele, M Sprik
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2008)
235
ORGN 260-Linear and bent halogen-bonded architectures in cocrystals: Design, properties and mechanism of formation via grinding
T Friscic, D Cincic, W Jones
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2008)
235
INOR 101-Gas storage in phosphine coordination materials
SM Humphrey, PK Allan, J-S Chang, YK Hwang, RM Lambert, SE Oungoulian, DJ Watson, ER Wise, HHM Yeung, JW Yoon
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2008)
235
POLY 554-Cucurbiturils in dynamic functional materials
OA Scherman
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2008)
235
Dynamic reversible supramolecular polymers bearing hydrogen bonding end groups
AD Celiz, OA Scherman
American Chemical Society Polymer Preprints Division of Polymer Chemistry
(2008)
235
INOR 144-Watching nanoparticles grow: The mechanism and kinetics for the formation of TiO2-supported platinum nanoparticles
PJ Chupas, KW Chapman, G Jennings, PL Lee, CP Grey
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2008)
235