Ke Chen - Publications, H-index & Citations

Ke Chen

Department of Chemistry

10H指数

26论文数

470被引数

收录论文 11

发表时间

Field-aware and charge-informed machine learning for predicting molecular and condensed-phase responses and vibrational spectra 场感知与电荷信息机器学习在预测分子及凝聚相响应和振动光谱中的应用

npj Computational Materials

IF11.9

2026-09-04

OAAI

Ke Chen; Sandra Luber

Benchmarking of Small Molecule Feature Representations for hERG, Nav1.5, and Cav1.2 Cardiotoxicity Prediction

JOURNAL OF CHEMICAL INFORMATION AND MODELING

IF5.3

2023-10-23

OAAI

Arab, Issar; Egghe, Kristof; Laukens, Kris; Chen, Ke; Barakat, Khaled; Bittremieux, Wout

Platinum based high entropy alloy oxygen reduction electrocatalysts for proton exchange membrane fuel cells 用于质子交换膜燃料电池的铂基高熵合金氧还原电催化剂

MATERIALS TODAY NANO

IF8.2

2023-03-01

PREAI

Shen, J.; Hu, Z.; Chen, K.; Chen, C.; Zhu, Y.; Li, C.

Photocatalytic C-N coupling towards urea synthesis with a palladium-supported CeO2 catalyst

CATALYSIS SCIENCE & TECHNOLOGY

IF4.2

2023-01-01

PREAI

Yang, Shuyi; Deng, Jiayi; Chen, Jiaying; Tan, Qingmei; Liu, Tianren; Chen, Ke; Han, Dongxue; Ma, Yingming; Dai, Mengjiao; Niu, Li

Physics-inspired machine learning of localized intensive properties

CHEMICAL SCIENCE

IF7.4

2023-01-01

OAAI

Chen, Ke; Kunkel, Christian; Cheng, Bingqing; Reuter, Karsten; Margraf, Johannes T.

Directed evolution of cytochrome P450DA hydroxylase activity for stereoselective biohydroxylation

CATALYSIS SCIENCE & TECHNOLOGY

IF4.2

2022-01-01

PREAI

Wan, Nan-Wei; Cui, Hai-Bo; Zhao, Ling; Shan, Jing; Chen, Ke; Wang, Zhong-Qiang; Zhou, Xiao-Jian; Cui, Bao-Dong; Han, Wen-Yong; Chen, Yong-Zheng

Reorganization energies of flexible organic molecules as a challenging target for machine learning enhanced virtual screening

DIGITAL DISCOVERY

IF5.6

2022-01-01

OAAI

Chen, Ke; Kunkel, Christian; Reuter, Karsten; Margraf, Johannes T.

Optimal build-operate-transfer road contracts under information asymmetry and uncertainty

TRANSPORTATION RESEARCH PART B-METHODOLOGICAL

IF6.3

2021-10-01

PREAI

Shi, Shasha; Yin, Yafeng; An, Qingxian; Chen, Ke

Subgroup Discovery Points to the Prominent Role of Charge Transfer in Breaking Nitrogen Scaling Relations at Single-Atom Catalysts on VS2

ACS CATALYSIS

IF13.1

2021-06-16

PREAI

Li, Haobo; Liu, Yunxia; Chen, Ke; Margraf, Johannes T.; Li, Youyong; Reuter, Karsten

Active discovery of organic semiconductors 有机半导体的积极发现

NATURE COMMUNICATIONS

IF15.7

2021-04-23

OAAI

Kunkel, Christian; Margraf, Johannes T.; Chen, Ke; Oberhofer, Harald; Reuter, Karsten

Core-shell CMNP@PDAP nanocomposites for simultaneous removal of chromium and arsenic

CHEMICAL ENGINEERING JOURNAL

IF13.2

2018-10-01

PREAI

Wu, Jin; Chen, Ke; Tan, Xiaoli; Fang, Ming; Hu, Xiaoye; Tang, Zhenwu; Wang, Xiangke

研究方向