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"RetroGNN: Approximating Retrosynthesis by Graph Neural Networks for De ..."

Cheng-Hao Liu et al. (2020)

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DOI: —

access: open

type: Informal or Other Publication

metadata version: 2021-10-14

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  - electronic edition @ arxiv.org (open access)
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  dblp key:
  - journals/corr/abs-2011-13042
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  persistent URL:
  - https://dblp.org/rec/journals/corr/abs-2011-13042
Cheng-Hao Liu, Maksym Korablyov, Stanislaw Jastrzebski, Pawel Wlodarczyk-Pruszynski, Yoshua Bengio, Marwin H. S. Segler:
RetroGNN: Approximating Retrosynthesis by Graph Neural Networks for De Novo Drug Design. CoRR abs/2011.13042 (2020)

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