Automated patent extraction powers generative modeling in focused chemical spaces

Deep generative models have emerged as an exciting avenue for inverse molecular design, with progress coming from the interplay between training algorithms and molecular representations. One of the key challenges in their applicability to materials science and chemistry has been the lack of access t...

Full description

Bibliographic Details
Main Authors: Subramanian, Akshay, P. Greenman, Kevin, Gervaix, Alexis, Yang, Tzuhsiung, Gómez-Bombarelli, Rafael
Other Authors: Massachusetts Institute of Technology. Department of Materials Science and Engineering
Format: Article
Language:English
Published: Royal Society of Chemistry 2024
Online Access:https://hdl.handle.net/1721.1/156922