标杆管理
生成语法
反向
计算机科学
人工智能
数学
业务
营销
几何学
作者
Tianle Yue,Lei Tao,Vikas Varshney,Ying Li
出处
期刊:Digital discovery
[Royal Society of Chemistry]
日期:2025-01-01
卷期号:4 (4): 910-926
被引量:50
摘要
This benchmark study evaluates deep learning-based molecular generative models on various polymer datasets. Selected models were further refined with reinforcement learning to generate hypothetical heat-resistant polymers.
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