ARSHIFT

aromatic/aryl chemical shift predictor


Synopsis

Structure based predictor of protein aromatic side-chain proton chemical shifts.

Description

A method of calculating side-chain aromatic chemical shifts from protein structures.

URL

http://www-mvsoftware.ch.cam.ac.uk/

Versions

NMRbox Version Software Version
1.0.0 Downloaded_2015-11-15,
2.0.0 Downloaded_2015-11-15,
3.0.0 Downloaded_2015-11-15,

Keywords

  • Chemical Shift Prediction

Citations

Using Side-Chain Aromatic Proton Chemical Shifts for a Quantitative Analysis of Protein Structures
Vendruscolo Michele, Sahakyan Aleksandr B, Vranken Wim F, Cavalli Andrea,
Angewandte Chemie International Edition. 2011; 50(41): 9620--9623