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  • Currently displaying 18301 - 18320 of 30130 publications
Author(s)
Publication title
Journal Name
Publication year
Structure of tumor suppressor p53 and its intrinsically disordered N-terminal transactivation domain
M Wells, H Tidow, TJ Rutherford, P Markwick, MR Jensen, E Mylonas, DI Svergun, M Blackledge, AR Fersht
Proceedings of the National Academy of Sciences of the United States of America
(2008)
105
Relaxation of caloric curves on complex potential energy surfaces
F Calvo, DJ Wales
Journal of Chemical Physics
(2008)
128
Measurement of amyloid fibril length distributions by inclusion of rotational motion in solution NMR diffusion measurements.
AJ Baldwin, SJ Anthony-Cahill, TPJ Knowles, G Lippens, J Christodoulou, PD Barker, CM Dobson
Angewandte Chemie International Edition
(2008)
47
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
Mixing in Adsorbed Monolayers:  Perfluorinated Alkanes
JE Parker, SM Clarke
Langmuir
(2008)
24
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
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
Analytical chemistry
(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
Coarse-Grained MD Simulations of Membrane Protein-Bilayer Self-Assembly
KA Scott, PJ Bond, A Ivetac, AP Chetwynd, S Khalid, MSP Sansom
Structure (London, England : 1993)
(2008)
16
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
Angewandte Chemie (International ed. in English)
(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
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
Third Virial Coefficient for 4‐Arm and 6‐Arm Star Polymers
S Caracciolo, BM Mognetti, A Pelissetto
Macromolecular Theory and Simulations
(2008)
17
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 135-Spatial and temporal coarse-graining in simulations of protein dynamics and complex formation
G Hummer, N-V Buchete, RB Best, W Zheng, Y-G Chen, YC Kim
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2008)
235
CINF 73-Molecular informatics: Research and learning
JM Goodman, JBO Mitchell, RC Glen
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2008)
235
COMP 62-Computation of acidity constants in solution from vertical energy gaps
M Sulpizi, A Shah, M Sprik
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2008)
235