Quantum Dot Light-Emitting Devices with Electroluminescence Tunable over the Entire Visible Spectrum
Polina O. Anikeeva,†,‡ Jonathan E. Halpert,†,§ Moungi G. Bawendi,§and Vladimir Bulovic´*,‡
Thad A. Harroun,*a Norbert Kucerka,b Mu-Ping Niehb and John Katsaras*b
Lisa E. Freed 1 2 *, George C. Engelmayr Jr. 2, Jeffrey T. Borenstein 1, Franklin T. Moutos 3, Farshid Guilak 3 |
Stefan Wetzel, Karsten Klein, Steffen Renner, Daniel Rauh, Tudor I Oprea, Petra Mutzel & Herbert Waldmann
We describe Scaffold Hunter, a highly interactive computer-based tool for navigation in chemical space that fosters intuitive recognition of complex structural relationships associated with bioactivity. The program reads compound structures and bioactivity data, generates compound scaffolds, correlates them in a hierarchical tree-like arrangement, and annotates them with bioactivity. Brachiation along tree branches from structurally complex to simple scaffolds allows identification of new ligand types. We provide proof of concept for pyruvate kinase.
Romas J Kazlauskas & Uwe T Bornscheuer
doi:10.1038/nchembio0809-526
Protein improvement strategies today involve widely varying combinations of rational design with random mutagenesis and screening. To make further progress—defined as making subsequent protein engineering problems easier to solve—protein engineers must critically compare these strategies and eliminate less effective ones.