Title: Ligand-Conditioned Side Chain Packing for Flexible Molecular DockingAuthors: Ding Luo, Xiaoyang Qu, Dexin Lu, Yiqiu Wang, Lina Dong, Binju WangAbstract: Molecular docking is a crucial technique for elucidating protein–ligand interactions. Machine learning-based docking methods offer promising advantages over traditional approaches, with significant potential for further development. How...

Title: Supramolecular Diodes with Donor–Acceptor InteractionsAuthors: Wei Xu, Hua Zhang, Yu Zhou, Taige Lu, Yuting Li, Yixuan Zhu, Caiyun Wei, Jueting Zheng, Ruihao Li, Jing Li, Lijue Chen, Guanxin Zhang, Jia Shi, Junyang Liu*, Deqing Zhang*, Wenjing Hong*Abstract: Inspired by the initial proposal of σ-bridged donor–acceptor (D-σ-A) single-molecule diodes in 1974, extensive studies over the...

Title: Revealing the CO Tolerance Mechanism in Acidic Hydrogen Oxidation Reactions on Platinum-Based Catalyst SurfacesAuthors: Zi-Han Chen, Xing Chen, Wei Kang, Shi-Sheng Zheng, Quan-Feng He, Qiong-Qiong Li, Yu-Xing Zhang, Yu-Cheng Hou, Jing-Hua Tian, Jin-Chao Dong, Jian-Feng Li*Abstract: The presence of trace CO impurity gas in hydrogen fuel can rapidly deactivate platinum-based hydrogen oxida...

Title: Catalyst-Free Nitrogen Fixation by Microdroplets through a Radical-Mediated Disproportionation Mechanism under Ambient ConditionsAuthors: Yanjie Wang, Jin Luo, Ye-Guang Fang, Zi-Ang Nan, Xi Cui, Ting Chen, Xiangbiao Zeng, Xiaofei Wang, Xianmeng Song, Jiawei Zhao, Weixin Li, Chen Zeng, Daliang Chen, Chongqin Zhu*, Zhenwei Wei*, Zhong-Qun Tian, Feng Ru Fan*Abstract: Nitrogen fixation is es...

Title: Molecular Photoelectrocatalysis for Radical ReactionsAuthors: Peng Xiong, Hai-Chao Xu*Abstract: Molecular photoelectrocatalysis, which combines the merits of photocatalysis and organic electrosynthesis, including their green attributes and capacity to offer novel reactivity and selectivity, represents an emerging field in organic chemistry that addresses the growing demands for environme...

 Title: Mechanically Robust Bismuth-Embedded Carbon Microspheres for Ultrafast Charging and Ultrastable Sodium-Ion BatteriesAuthors: Jianhai Pan, Zhefei Sun, Xiaoyu Wu, Tongchao Liu*, Yurui Xing, Jiawei Chen, Zhichen Xue, Dafu Tang, Xiaoli Dong, Hongti Zhang, Haodong Liu, Qiulong Wei, Dong-Liang Peng, Khalil Amine*, Qiaobao Zhang*Abstract: Advancements in the development of fast-charging and lo...

Title: Optimized Adsorption of Had and OHad over Amorphous SrRuPtOxHy Nanobelts towards Efficient Alkaline Fuel Cell CatalysisAuthors: Siyu Liu, Shangheng Liu, Jingliang Bao, Zhongliang Huang, Licheng Wei, Nanjun Chen, Zhiwei Hu, Wei-Hsiang Huang, Chih-Wen Pao, Qingyu Kong, Jiajia Han, Leigang Li, Xiaoqing Huang*Abstract: PtRu-based catalysts toward hydrogen oxidation reaction (HOR) suffer from...

Title: Surface-enhanced Raman spectroscopy: a half-century historical perspectiveAuthors: Jun Yi, En-Ming You, Ren Hu, De-Yin Wu, Guo-Kun Liu, Zhi-Lin Yang, Hua Zhang, et al.Abstract: Surface-enhanced Raman spectroscopy (SERS) has evolved significantly over fifty years into a powerful analytical technique. This review aims to achieve five main goals. (1) Providing a comprehensive history of SER...

Title: Phase Engineering Facilitates O–O Coupling via Lattice Oxygen Mechanism for Enhanced Oxygen Evolution on Nickel–Iron PhosphideAuthors: Zheng-Xin Qian, Ge-Hao Liang, Liang-Fei Shen, Ge Zhang, Shisheng Zheng, Jing-Hua Tian, Jian-Feng Li, Hua Zhang*Abstract: Nickel–iron-based catalysts are recognized for their high efficiency in the oxygen evolution reaction (OER) under alkaline conditio...

Title: Disulfide-Directed Multicyclic Peptides with N-Terminally Extendable α-Helices for Recognition and Activation of G Protein-Coupled ReceptorsAuthors: Shihui Fan, Jie Li, Jie Zhuang, Qingtong Zhou, Yiting Mai, Bingni Lin, Ming-Wei Wang*, Chuanliu Wu*Abstract: Many peptide hormones adopt long α-helical structures upon interacting with their cognate receptors but often exhibit flexible con...