Trustworthy Inverse Molecular Design via Alignment with Molecular Dynamics by Kevin Tirta Wijaya, Navid Ansari, Hans‐Peter Seidel, Vahid Babaei

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A dynamic programming algorithm for generating chemical isomers based on frequency vectors by Ryota Ido, Naveed Ahmed Azam, Jianshen Zhu, Hiroshi Nagamochi, Tatsuya Akutsu

Subjects: “…Molecular Design…”
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Editorial: New developments in bioinorganic and bioorganic chemistry by Isabel Correia, Sylvia M. Draper

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Topological effects on the concrete transportation inhibitors: Nano-mechanisms and design principles by Chengbo Liu, Yihan Wang, Qing Liu, Pan Wang, Yue Zhang, Xinpeng Wang, Dongshuai Hou, Fengxia Xu, Muhan Wang

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DerivaPredict: A User-Friendly Tool for Predicting and Evaluating Active Derivatives of Natural Products by Yu Song, Meng Zhang, Sihao Chang, Ganghui Chu, Hongchao Ji

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Molecular design of phenolic type extractants by Yu. S. Suntsova, D. V. Bychenkov, S. A. Semenov, A. M. Reznik

Subjects: “…molecular design…”
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Precisely Tailoring Molecular Structure of Doxorubicin Prodrugs to Enable Stable Nanoassembly, Rapid Activation, and Potent Antitumor Effect by Chengcheng Feng, Yuting Wang, Jiaxu Xu, Yanzi Zheng, Wenhu Zhou, Yuequan Wang, Cong Luo

Subjects: “…molecular design…”
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Design and Performance Studies on Series of Tetrazole-Based Ultra-High-Energy Density High-Nitrogen Heterocyclic Power Systems by Yunqiu Li, Qiyao Yu

Subjects: “…molecular design…”
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An Effective Pipeline for Training Variational Autoencoders for Synthesizable and Optimized Molecular Design by Fardeen H. Mozumder, Byung-Jun Yoon

Subjects: “…Generative molecular design (GMD)…”
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Concealed antiaromaticity [version 1; peer review: 1 approved, 2 approved with reservations] by Florian Glöcklhofer

Subjects: “…molecular design…”
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Salinity survival: molecular mechanisms and adaptive strategies in plants by Huankai Zhang, Caiyu Yu, Qian Zhang, Zihan Qiu, Xiansheng Zhang, Xiansheng Zhang, Yifeng Hou, Jie Zang

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Generative AI for drug discovery and protein design: the next frontier in AI-driven molecular science by Uddalak Das

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Identifying the determining factors of detonation properties for linear nitroaliphatics with high-throughput computation and machine learning by Wen Qian, Jing Huang, Shi-tai Guo, Bo-wen Duan, Wei-yu Xie, Jian Liu, Chao-yang Zhang

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Generative artificial intelligence based models optimization towards molecule design enhancement by Tarek Khater, Sara Awni Alkhatib, Aamna AlShehhi, Charalampos Pitsalidis, Anna Maria Pappa, Son Tung Ngo, Vincent Chan, Vi Khanh Truong

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PROTAC^® technology and potential for its application in infection control by M. A. Zakharova, M. V. Chudinov

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QTN mapping, gene prediction and molecular design breeding of seed protein content in soybean by Doudou Zhang, Xu Sun, Bo Hu, Wen-Xia Li, Hailong Ning

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Effects of Residual Water on Proton Transfer-Switching Molecular Device by Hiroto Tachikawa

Subjects: “…molecular design…”
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Quadratic descriptors and reduction methods in a two-layered model for compound inference by Jianshen Zhu, Naveed Ahmed Azam, Shengjuan Cao, Ryota Ido, Kazuya Haraguchi, Liang Zhao, Hiroshi Nagamochi, Tatsuya Akutsu

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AI-Driven Chemical Design: Transforming the Sustainability of the Pharmaceutical Industry by Antonio Ruiz-Gonzalez

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Editorial: Application of PKPD modeling in drug discovery and development by Hong-Can Ren, Xiao Zhu, Kun Hao, Si-Yuan Le

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