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A Symmetry adapted tessellation of the GEPOL surface: applications to molecular properties in solution.
Christian Silvio Pomelli
Jacopo Tomasi
Roberto Cammi
Published in:
J. Comput. Chem. (2001)
Keyphrases
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three dimensional
d objects
neural network
linear equations
surface reconstruction
desirable properties
ligand docking
optimal solution
object recognition
closed form
integer programming
reconstruction method
geometrical properties
invariance properties
van der waals