机构

• 上海药物研究所 [48]
• 生态环境研究中心 [2]
• 古脊椎动物与古人类研... [2]
• 地理科学与资源研究所 [1]
• 化学研究所 [1]

采集方式

• OAI收割 [54]

内容类型

• 期刊论文 [54]

发表日期

• 2025 [5]
• 2024 [17]
• 2023 [6]
• 2022 [8]
• 2021 [6]
• 2020 [6]
• 更多

学科主题

筛选

浏览/检索结果: 共54条，第1-10条 帮助 条数/页： 5101520253035404550556065707580859095100 排序方式： 请选择发表日期升序发表日期降序题名升序题名降序提交时间升序提交时间降序作者升序作者降序 Discovery and Identification of a Novel PORCN Inhibitor via Structure-Based Virtual Screening 期刊论文  OAI收割 ACS CHEMICAL BIOLOGY, 2025, 卷号: 20, 期号: 6, 页码: 1319-1332 作者:  Yang, Xinyu;  Li, Yanbei;  Zhou, Jingyi;  Zhou, Yuanyang;  Lin, Kexin   |  收藏  |  浏览/下载：8/0  |  提交时间：2025/07/25 Palladium-Catalyzed Enantioselective Arylative Dearomatization of Naphthols and Phenols for Constructing Quinazoline-Containing Spirocycles 期刊论文  OAI收割 ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, 2025, 页码: 9 作者:  Zhang, Chiyue;  Xu, Gaoya;  Zhao, Wenlu;  Li, Xutong;  Zheng, Mingyue   |  收藏  |  浏览/下载：15/0  |  提交时间：2025/07/25 Antiproliferative activity  Catalytic asymmetric dearomatization  Palladium  Quinazoline-containing spirocycles  Three-dimensionality   Targeted Synergistic Priorities for Conserving Biodiversity, Carbon, and Water on the Qinghai-Tibetan Plateau 期刊论文  OAI收割 EARTHS FUTURE, 2025, 卷号: 13, 期号: 3, 页码: e2024EF004802 作者:  Ye, Chongchong;  Wang, Shuai;  Wu, Xutong;  Lee, Tien Ming;  Wang, Yi   |  收藏  |  浏览/下载：24/0  |  提交时间：2025/04/21 biodiversity conservation  ecosystem services  multi-objective conservation  synergy networks  global biodiversity framework   Discovery of novel covalent stabilizers for p53 Y220C using structure-based drug discovery methods 期刊论文  OAI收割 MOLECULAR DIVERSITY, 2025, 页码: 14 作者:  Wen, Yiming;  Xu, Peijia;  Chen, Yijie;  Meng, Jingyi;  Zheng, Mingyue   |  收藏  |  浏览/下载：27/0  |  提交时间：2025/04/01 p53 Y220C  Covalent stabilizer  Virtual screening  Molecular dynamics  DNA binding  Structure-activity relationship  Cancer therapy   Prediction of Solvate Based on Graph Attention Network 期刊论文  OAI收割 CRYSTAL GROWTH & DESIGN, 2025, 卷号: 25, 期号: 2, 页码: 297-308 作者:  Sun, Shihui;  Wang, Jian-Rong;  Tang, Lei;  Fan, Zhehuan;  Li, Xutong   |  收藏  |  浏览/下载：21/0  |  提交时间：2025/04/01 SurfDock is a surface-informed diffusion generative model for reliable and accurate protein-ligand complex prediction 期刊论文  OAI收割 NATURE METHODS, 2024, 页码: 24 作者:  Cao, Duanhua;  Chen, Mingan;  Zhang, Runze;  Wang, Zhaokun;  Huang, Manlin   |  收藏  |  浏览/下载：17/0  |  提交时间：2025/01/06 miCGR: interpretable deep neural network for predicting both site-level and gene-level functional targets of microRNA 期刊论文  OAI收割 BRIEFINGS IN BIOINFORMATICS, 2024, 卷号: 26, 期号: 1, 页码: 13 作者:  Wu, Xiaolong;  Zhang, Lehan;  Tong, Xiaochu;  Wang, Yitian;  Zhang, Zimei   |  收藏  |  浏览/下载：15/0  |  提交时间：2024/12/25 MicroRNA  target prediction  chaos game representation  deep learning  convolutional neural network   Prediction of Multi-Pharmacokinetics Property in Multi-Species: Bayesian Neural Network Stacking Model with Uncertainty 期刊论文  OAI收割 MOLECULAR PHARMACEUTICS, 2024, 页码: 16 作者:  Zhang, Yuanyuan;  Xie, Zhiyin;  Xiao, Fu;  Yu, Jie;  Fan, Zhehuan   |  收藏  |  浏览/下载：15/0  |  提交时间：2024/12/11 pharmacokinetic parameters  machine learning  uncertainty  stacking  multitask learning  ADME   Identifying compound-protein interactions with knowledge graph embedding of perturbation transcriptomics 期刊论文  OAI收割 CELL GENOMICS, 2024, 卷号: 4, 期号: 10, 页码: 100655 作者:  Ni, Shengkun   |  收藏  |  浏览/下载：17/0  |  提交时间：2025/06/04 Gram matrix: an efficient representation of molecular conformation and learning objective for molecular pretraining 期刊论文  OAI收割 BRIEFINGS IN BIOINFORMATICS, 2024, 卷号: 25, 期号: 4, 页码: 13 作者:  Xiang, Wenkai;  Zhong, Feisheng;  Ni, Lin;  Zheng, Mingyue;  Li, Xutong   |  收藏  |  浏览/下载：24/0  |  提交时间：2024/09/26 gram matrix  graph transformer  molecular property prediction