AI for Interpretable Chemistry: Predicting Radical Mechanistic Pathways via Contrastive Learning

Item #:

075280-0178

Details

DOI: https://doi.org/10.52202/075280-0178
Author(s): Pierre Baldi, Ann Marie Carlton, Yin Ting Chiu, Alexander Shmakov, Mohammadamin Tavakoli, David Van Vranken
Pages: 4080-4096 (17 pages)
Format: PDF Paper Download
Conference: Advances in Neural Information Processing Systems 36
Date/Location: Held 10-16 December 2023, New Orleans, Louisiana, USA.
Series: Advances in Neural Information Processing Systems 36
Publisher: Neural Information Processing Systems Foundation, Inc. (NeurIPS)

DOI: https://doi.org/10.52202/075280-0178
Author(s): Pierre Baldi, Ann Marie Carlton, Yin Ting Chiu, Alexander Shmakov, Mohammadamin Tavakoli, David Van Vranken
Pages: 4080-4096 (17 pages)
Format: PDF Paper Download
Conference: Advances in Neural Information Processing Systems 36
Date/Location: Held 10-16 December 2023, New Orleans, Louisiana, USA.
Series: Advances in Neural Information Processing Systems 36
Publisher: Neural Information Processing Systems Foundation, Inc. (NeurIPS)