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Pei Liu · xiangxiang Zeng · Tengfei Ma · Yucheng Xing · Xuanbai Ren · Yiping Liu
Xuanbai Ren · Luoda Tan · Pei Liu · Tengfei Ma · Xiangzheng Fu · Longyue Wang · Yiping Liu · xiangxiang Zeng
Transfer learning has demonstrated efficacy in single-property constraint molecular generation. However, real-world drug discovery demands molecules to satisfy multiple property constraints. Existing paradigms often struggle with this challenge due to catastrophic forgetting or gradient conflicts...