DOI Bookmark:
http://doi.ieeecomputersociety.org/10.1109/TCBB.2009.57
The functions of proteins is often realized through their mutual interactions. Determining a relative transformation for a pair of proteins and their conformations which form a stable complex, reproducible in nature, is known as docking. It is an important step in drug design, structure determination and understanding function and structure relationships. We provide a scoring model for rigid docking and error-bounded approximation algorithms to predict docking sites. Translational search is sped up using the Fourier domain. Shape based interactions is shown to give good results for a large range of pairs of proteins.
Index Terms:
Geometrical problems and computations, Computation of transforms
Citation:
Chandrajit L. Bajaj, Rezaul Chowdhury, Vinay Siddahanavalli, "F²Dock: Fast Fourier Protein-Protein Docking," IEEE/ACM Transactions on Computational Biology and Bioinformatics, 03 Jun. 2009. IEEE computer Society Digital Library. IEEE Computer Society, <http://doi.ieeecomputersociety.org/10.1109/TCBB.2009.57>
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