Josep Arús-Pous

icon indicating a website link http://joseparus.com icon indicating an email [email protected]

icon company @Roche icon location Basel icon location I'm a computer scientist and a doctor in deep learning applied to drug discovery that loves science, music & nerdiness in general!

Results 3 repositories owned by Josep Arús-Pous

reinvent-randomized

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Recurrent Neural Network using randomized SMILES strings to generate molecules

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reinvent-gdb13

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A Recurrent Neural Network implementation that uses SMILES strings to generate molecules from GDB-13

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reinvent-scaffold-decorator

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A SMILES-based encoder-decoder architecture for molecular scaffold decoration

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