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Graph-based processing of macromolecular information
(Bentham Science, 2015)
[Abstract] The complex information encoded into the element connectivity of a system gives rise to the possibility of graphical processing of divisible systems by using the Graph theory. An application in this sense is the ...
Evolutionary Computation and QSAR Research
(Bentham Science, 2013)
[Abstract] The successful high throughput screening of molecule libraries for a specific biological property is one of the main improvements in drug discovery. The virtual molecular filtering and screening relies greatly ...