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Issue No.02 - March/April (2011 vol.8)
pp: 557-563
Juan Cortés , LAAS-CNRS, Toulouse, France
Sophie Barbe , LISBP, Toulouse, France
Monique Erard , IPBS-CNRS, Toulouse, France
Thierry Siméon , LAAS-CNRS, Toulouse, France
This paper builds on the combination of robotic path planning algorithms and molecular modeling methods for computing large-amplitude molecular motions, and introduces voxel maps as a computational tool to encode and to represent such motions. We investigate several applications and show results that illustrate the interest of such representation.
Simulation, modeling, visualization, computer applications to biology, robotics.
Juan Cortés, Sophie Barbe, Monique Erard, Thierry Siméon, "Encoding Molecular Motions in Voxel Maps", IEEE/ACM Transactions on Computational Biology and Bioinformatics, vol.8, no. 2, pp. 557-563, March/April 2011, doi:10.1109/TCBB.2010.23
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