未登录 Terrestrial jumping assay for adult zebrafish as a potential tool to assess motor, affective and drug-evoked phenotypes 成年斑马鱼陆地跳跃实验作为一种评估运动、情感和药物诱导表型的潜在工具 Bai, Ruyue; Li, Zichen; Wang, Yimeng; Wang, Gaomuyi; Wang, Yingze; Chu, Jiale; Yao, Haojun; Sawitri, Ni Luh Nitya; Fu, Zhike; Suo, Qinglu; Cai, Huiling; Zhao, Chongguang; Lu, Qinming; He, Zhixuan; Jiang, Xilei; Pang, Yixuan; Yang, Longen; Cui, Jiahao; de Abreu, Murilo S.; Stewart, Adam Michael; Perfilova, Valentina N.; Kalueff, Allan, V 分享 收藏
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A workflow to create a high-quality protein-ligand binding dataset for training, validation, and prediction tasks 创建用于训练、验证和预测任务的高质量蛋白质-配体结合数据集的工作流程 Wang, Yingze; Sun, Kunyang; Li, Jie; Guan, Xingyi; Zhang, Oufan; Bagni, Dorian; Zhang, Yang; Carlson, Heather A.; Head-Gordon, Teresa 分享 收藏
Mining for Potent Inhibitors through Artificial Intelligence and Physics: A Unified Methodology for Ligand Based and Structure Based Drug Design 通过人工智能和物理学挖掘有效的抑制剂: 基于配体和基于结构的药物设计的统一方法 Li, Jie; Zhang, Oufan; Sun, Kunyang; Wang, Yingze; Guan, Xingyi; Bagni, Dorian; Haghighatlari, Mojtaba; Kearns, Fiona L.; Parks, Conor; Amaro, Rommie E.; Head-Gordon, Teresa 分享 收藏
DMFF: An Open-Source Automatic Differentiable Platform for Molecular Force Field Development and Molecular Dynamics Simulation DMFF: 用于分子力场开发和分子动力学模拟的开源自动可微分平台 Wang, Xinyan; Li, Jichen; Yang, Lan; Chen, Feiyang; Wang, Yingze; Chang, Junhan; Chen, Junmin; Feng, Wei; Zhang, Linfeng; Yu, Kuang 分享 收藏
DeePMD-kit v2: A software package for deep potential models Deepmd-kit v2: 用于深潜模型的软件包 Zeng, Jinzhe; Zhang, Duo; Lu, Denghui; Mo, Pinghui; Li, Zeyu; Chen, Yixiao; Rynik, Marian; Huang, Li'ang; Li, Ziyao; Shi, Shaochen; Wang, Yingze; Ye, Haotian; Tuo, Ping; Yang, Jiabin; Ding, Ye; Li, Yifan; Tisi, Davide; Zeng, Qiyu; Bao, Han; Xia, Yu; Huang, Jiameng; Muraoka, Koki; Wang, Yibo; Chang, Junhan; Yuan, Fengbo; Bore, Sigbjorn Loland; Cai, Chun; Lin, Yinnian; Wang, Bo; Xu, Jiayan; Zhu, Jia-Xin; Luo, Chenxing; Zhang, Yuzhi; Goodall, Rhys E. A.; Liang, Wenshuo; Singh, Anurag Kumar; Yao, Sikai; Zhang, Jingchao; Wentzcovitch, Renata; Han, Jiequn; Liu, Jie; Jia, Weile; York, Darrin M.; E, Weinan; Car, Roberto; Zhang, Linfeng; Wang, Han 分享 收藏