most citedGenerative Enriched Sequential Learning (ESL) Approach for Molecular Design via Augmented Domain Knowledge

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q-bio.BM2022★ 1 cited

Generative Enriched Sequential Learning (ESL) Approach for Molecular Design via Augmented Domain Knowledge

Mohammad Sajjad Ghaemi, Karl Grantham, Isaac Tamblyn +2

Deploying generative machine learning techniques to generate novel chemical structures based on molecular fingerprint representation has been well established in molecular design.…