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"Structure-Based Molecule Optimization via Gradient-Guided Bayesian Update."
Keyue Qiu et al. (2024)
- Keyue Qiu, Yuxuan Song, Jie Yu, Hongbo Ma, Ziyao Cao, Zhilong Zhang, Yushuai Wu, Mingyue Zheng, Hao Zhou, Wei-Ying Ma:
Structure-Based Molecule Optimization via Gradient-Guided Bayesian Update. CoRR abs/2411.13280 (2024)
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