Dmitry Yu. Zubarev | DeepAI

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Payel Das
56 publications
Vijil Chenthamarakshan
27 publications
Samuel C. Hoffman
12 publications
Petar Ristoski
4 publications
Daniel P. Sanders
4 publications

research

∙ 07/29/2022

Topology-Driven Generative Completion of Lacunae in Molecular Data

We introduce an approach to the targeted completion of lacunae in molecu...

0 Dmitry Yu. Zubarev, et al. ∙

research

∙ 12/02/2021

Sample-Efficient Generation of Novel Photo-acid Generator Molecules using a Deep Generative Model

Photo-acid generators (PAGs) are compounds that release acids (H^+ ions)...

3 Samuel C. Hoffman, et al. ∙