Potential fields represented by irregular, deformable 3D grids provide an accurate and efficient lookup table function for evaluating intermolecular interactions in docking algorithms that consider target flexibility. Target movements can be translated into appropriate displacements of grid intersection points in a binding site region if the irregular deformable 3D grid is modeled as a homogeneous linear elastic body.
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Kazemi et al. (2009) studied this question.
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