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synthesis planning

4 papers

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Co-occurring keywords · papers mentioning both

chemical reaction (3) molecular generation (2) generative model (2) reaction template (1) retrosynthetic analysis (1) molecule synthesis (1) neural network (1) chemical space (1) bidirectional search (1) graph search (1)

Papers

SynFlowNet: Design of Diverse and Novel Molecules with Synthesis Constraints ICLR 2025 Double-Ended Synthesis Planning with Goal-Constrained Bidirectional Search NeurIPS 2024 Amortized Tree Generation for Bottom-up Synthesis Planning and Synthesizable Molecular Design ICLR 2022 Barking up the right tree: an approach to search over molecule synthesis DAGs NeurIPS 2020