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Phosphoinositide, Phosphopeptide and Pyridone Interactions of the Abl SH2 Domain

✍ Scribed by Etienne Tokonzaba; Daniel G. S. Capelluto; Tatiana G. Kutateladze; Michael Overduin


Book ID
111368276
Publisher
John Wiley and Sons
Year
2006
Tongue
English
Weight
513 KB
Volume
67
Category
Article
ISSN
1747-0277

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## Abstract The accurate and efficient calculation of binding free energies is essential in computational biophysics. We present a linear‐scaling quantum mechanical (QM)‐based end‐point method termed MM/QM‐COSMO to calculate binding free energies in biomolecular systems, with an improved descriptio