Search Results for author: Carlos Outeiral

Found 3 papers, 1 papers with code

Generative artificial intelligence for de novo protein design

no code implementations15 Oct 2023 Adam Winnifrith, Carlos Outeiral, Brian Hie

Engineering new molecules with desirable functions and properties has the potential to extend our ability to engineer proteins beyond what nature has so far evolved.

Protein Design

Objective-Reinforced Generative Adversarial Networks (ORGAN) for Sequence Generation Models

1 code implementation30 May 2017 Gabriel Lima Guimaraes, Benjamin Sanchez-Lengeling, Carlos Outeiral, Pedro Luis Cunha Farias, Alán Aspuru-Guzik

In unsupervised data generation tasks, besides the generation of a sample based on previous observations, one would often like to give hints to the model in order to bias the generation towards desirable metrics.

 Ranked #1 on Molecular Graph Generation on ZINC (QED Top-3 metric)

Molecular Graph Generation Music Generation +1

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