ECloudGen: leveraging electron clouds as a latent variable to scale up structure-based molecular design

作者：Odin Zhang, Jieyu Jin, Zhenxing Wu, Jintu Zhang, Ping Yuan, Yuntao Yu, Haitao Lin, Haiyang Zhong, Xujun Zhang, Chenqing Hua, Weibo Zhao, Zhengshuo Zhang, Kejun Ying, Yufei Huang, Huifeng Zhao, Yu Kang, Peichen Pan, Jike Wang, Dong Guo, Shuangjia Zheng, Chang‐Yu Hsieh, Tingjun Hou · 发表于：Nature Computational Science · 年份：2025 · DOI：10.1038/s43588-025-00886-7 · 被引用次数：4 · 研究领域：Click Chemistry and Applications、Computational Drug Discovery Methods、Machine Learning in Materials Science