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Journal Articles IEEE/ACM Transactions on Computational Biology and Bioinformatics Year : 2011

Encoding Molecular Motions in Voxel Maps

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Abstract

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.
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Dates and versions

hal-02652128 , version 2 (18-01-2019)
hal-02652128 , version 1 (29-05-2020)

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Juan Cortés, Sophie Barbe, Monique Erard, Thierry Simeon. Encoding Molecular Motions in Voxel Maps. IEEE/ACM Transactions on Computational Biology and Bioinformatics, 2011, 8 (2), pp.557-563. ⟨10.1109/TCBB.2010.23⟩. ⟨hal-02652128v2⟩
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