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Machine-made chemistry 千篇一律的化学。
IF 51.7 1区 化学 Q1 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2025-11-11 DOI: 10.1038/s41570-025-00775-7
Emmanuel Adu Fosu, Jindou Yang
Developing universal machine learning potentials for heterogeneous catalysis still presents challenges. Recently, an element-based potential using random exploration via imaginary chemicals was developed and predicts reactions accurately across various scenarios related to catalytic systems and materials science.
开发多相催化的通用机器学习潜力仍然存在挑战。最近,一种基于元素的势能方法通过假想的化学物质进行随机探索,可以准确地预测与催化系统和材料科学相关的各种情况下的反应。
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引用次数: 0
Meditations from an air quality master 空气质量专家的冥想
IF 51.7 1区 化学 Q1 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2025-11-10 DOI: 10.1038/s41570-025-00777-5
Lidia Morawska, Stephanie Greed
Ahead of her 73rd birthday, Lidia Morawska, Distinguished Professor at Queensland University of Technology, discusses her life as a researcher and advocate of clean air.
在她73岁生日前夕,昆士兰科技大学杰出教授莉迪亚·莫拉斯卡(Lidia Morawska)讨论了她作为研究人员和清洁空气倡导者的生活。
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引用次数: 0
Publisher Correction: Dynamics in electrochemical organic oxidation reactions from in situ and operando techniques 出版商更正:电化学有机氧化反应动力学从原位和operando技术
IF 36.3 1区 化学 Q1 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2025-11-10 DOI: 10.1038/s41570-025-00785-5
Basundhara Dasgupta, Debabrata Bagchi, Tobias Sontheimer, Matthias Driess, Prashanth W. Menezes
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引用次数: 0
Small but powerful 小而有力。
IF 51.7 1区 化学 Q1 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2025-11-04 DOI: 10.1038/s41570-025-00772-w
Andrew V. Stachulski, Christopher J. Schofield
Fifty years ago, researchers from Beecham Pharmaceuticals reported on the structure of clavulanic acid. Itself only a weak antibiotic, clavulanic acid inhibits serine β-lactamases and thus this work pioneered combination therapy to protect antibiotics against the development of resistance.
50年前,比彻姆制药公司的研究人员报道了克拉维酸的结构。克拉维酸本身只是一种弱抗生素,它抑制丝氨酸β-内酰胺酶,因此这项工作开创了联合治疗的先驱,以保护抗生素免受耐药性的发展。
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引用次数: 0
Small-molecule control of CAR T cells CAR - T细胞的小分子控制
IF 51.7 1区 化学 Q1 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2025-10-29 DOI: 10.1038/s41570-025-00768-6
Eric L. Adams, Andrew C. McGovern, Victor So, Sneha Srinivasan, Alexander Deiters, Jason Lohmueller
Chimeric antigen receptor (CAR) T cell therapy is a ‘living drug’ in which the T cells of patients are genetically engineered with an artificial receptor that directs them to attack diseased cells. CAR T cell therapies have had remarkable impact, curing subsets of patients with previously untreatable, late-stage cancers. However, limitations persist, including severe toxicities, limited survival of engineered cells, and therapeutic resistance. Genetically encoded small-molecule control systems have been developed to address these limitations. They can halt toxicities by eliminating CAR T cells or switching off their function. Furthermore, they can enhance therapy by directly targeting antigens or broadening cell killing ability through cytotoxic pro-drug activation. Small-molecule controllers include protease inhibitors, protein dimerizers, protein degraders, bi-specific adaptors and conditionally activated chemotherapeutics. Here, we outline small-molecule-based control approaches, categorizing them by function and detailing their molecular mechanisms. We emphasize systems in the clinic and highlight emerging applications and unmet areas. Chimeric antigen receptor (CAR) T cells are a promising and effective cancer therapy but are difficult to regulate once implanted. This Review covers an emerging wave of small-molecule-based systems developed to control, augment and direct CAR T cell therapeutics.
嵌合抗原受体(CAR) T细胞疗法是一种“活的药物”,在这种疗法中,患者的T细胞经过基因工程改造,带有人工受体,引导它们攻击患病细胞。CAR - T细胞疗法已经产生了显著的影响,治愈了以前无法治疗的晚期癌症患者。然而,局限性仍然存在,包括严重的毒性、有限的工程细胞存活和治疗耐药性。遗传编码的小分子控制系统已经被开发出来以解决这些限制。它们可以通过消除CAR - T细胞或关闭它们的功能来阻止毒性。此外,它们可以通过直接靶向抗原或通过细胞毒性前药物激活扩大细胞杀伤能力来增强治疗效果。小分子控制器包括蛋白酶抑制剂,蛋白质二聚体,蛋白质降解剂,双特异性接头和条件激活化疗药物。在这里,我们概述了基于小分子的控制方法,按功能对它们进行分类,并详细介绍了它们的分子机制。我们强调系统在临床和突出新兴的应用和未满足的领域。嵌合抗原受体(CAR - T)细胞是一种很有前途和有效的癌症治疗方法,但一旦植入就难以调节。本综述涵盖了新兴的一波基于小分子的系统,用于控制、增强和指导CAR - T细胞治疗。
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引用次数: 0
Production of bio-based lactones as monomers for a circular polymer economy 以生物基内酯为单体的循环聚合物经济生产。
IF 51.7 1区 化学 Q1 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2025-10-22 DOI: 10.1038/s41570-025-00765-9
Daniyal Kiani, Ross Eaglesfield, James H. May, Allison Z. Werner, Eugene Y.-X. Chen, Yuriy Román-Leshkov, Yomaira J. Pagán-Torres, Gregg T. Beckham
To create a circular plastics economy, new polymers are being developed that can be chemically recycled. Circular polyesters are of particular interest and to this end, lactones are ideal monomers. This Review examines catalytic routes to convert diols, hydroxy acids, and dicarboxylic acids to lactones, focusing on the development of scalable, atom-economic, and energy-efficient conversions of bio-derived feedstocks. Free energy analysis is used to inform process choices, such as reactor type, reaction phase, and use of solvent. Catalyst design principles are summarized for both direct (bio-substrate to lactone) and indirect (bio-substrate to intermediate to lactone) routes. Finally, we summarize literature that shows that many lactone precursors are readily accessible from various metabolic and chemo-catalytic pathways. Transitioning to bio-based monomers offers an opportunity to reduce reliance on fossil carbon resources, but requires advanced catalytic processes informed by mechanistic insights. Catalytic methods for converting bio-derived feedstocks into lactones are reviewed, emphasizing scalable, energy-efficient processes. Free energy analysis guides process design and pathway selection, whereas literature highlights accessible lactone precursors from various metabolic and chemo-catalytic pathways.
为了创造循环塑料经济,人们正在开发可以化学回收的新型聚合物。圆形聚酯是特别感兴趣的,为此目的,内酯是理想的单体。本文综述了将二醇、羟基酸和二羧酸转化为内酯的催化途径,重点介绍了生物源原料可扩展、原子经济和节能转化的发展。自由能分析用于告知工艺选择,如反应器类型,反应阶段和溶剂的使用。总结了直接(生物底物到内酯)和间接(生物底物到中间体到内酯)途径的催化剂设计原则。最后,我们总结了表明许多内酯前体很容易从各种代谢和化学催化途径获得的文献。向生物基单体的过渡为减少对化石碳资源的依赖提供了机会,但需要先进的催化过程。
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引用次数: 0
Chronicles from the crystallography connoisseur 编年史来自晶体学鉴赏家。
IF 51.7 1区 化学 Q1 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2025-10-21 DOI: 10.1038/s41570-025-00769-5
Judith Howard, Stephanie Greed
Ahead of her 80th birthday, Judith Howard discussed her life in science, including the importance of women in crystallography from its inception, and her favourite breakthroughs in this field.
在她80岁生日之前,朱迪思·霍华德讨论了她的科学生涯,包括女性在晶体学诞生之初的重要性,以及她在这个领域最喜欢的突破。
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引用次数: 0
Dynamics in electrochemical organic oxidation reactions from in situ and operando techniques 电化学有机原位氧化反应动力学及操作技术。
IF 51.7 1区 化学 Q1 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2025-10-20 DOI: 10.1038/s41570-025-00767-7
Basundhara Dasgupta, Debabrata Bagchi, Tobias Sontheimer, Matthias Driess, Prashanth W. Menezes
Electrochemical organic oxidation reactions (OORs) play a pivotal role in various industrial processes and sustainable chemical production, transforming small molecules into value-added products. Understanding electrode surface dynamics, catalyst structures, reaction intermediates and product selectivity during OOR is crucial for both fundamental knowledge and the design of high-performance electrocatalysts and economically valuable reactions. The advancement of in situ and operando techniques, especially X-ray absorption and Raman and infrared spectroscopies, as well as differential electrochemical mass spectrometry, provide powerful tools for studying OORs. In situ methods reveal catalyst structural changes under applied bias and reaction-relevant conditions, whereas operando techniques simultaneously monitor both structure and activity in real operating conditions. This Review addresses the achievements towards closing the knowledge gap between fundamental, lab-scale studies and industrial, large-scale applications using in situ and operando techniques to uncover bulk catalyst structures, catalyst–surface–electrolyte dynamics and local transient product formation during anodic OORs. It also highlights the underlying principles of these techniques, offering perspectives on future prospects and challenges for advancing OOR applications, particularly in discovering next-generation efficient catalysts. This Review discusses the advancements and challenges of in situ and operando techniques for deciphering electrochemical organic oxidation reactions, focusing on the structural evolution of catalysts, adsorbed intermediates, transient product species, and the prospects for enhancing mechanistic understanding and catalyst development.
电化学有机氧化反应(OORs)在各种工业过程和可持续化工生产中发挥着关键作用,将小分子转化为增值产品。了解电极表面动力学,催化剂结构,反应中间体和产物选择性在OOR过程中对基础知识和设计高性能电催化剂和具有经济价值的反应至关重要。原位和操作技术的进步,特别是x射线吸收、拉曼光谱和红外光谱,以及微分电化学质谱,为研究OORs提供了有力的工具。原位法揭示了催化剂在施加偏置和反应相关条件下的结构变化,而operando技术在实际操作条件下同时监测催化剂的结构和活性。本文综述了在缩小基础实验室规模研究与工业大规模应用之间的知识差距方面取得的成就,利用原位和operando技术揭示了阳极OORs过程中的大块催化剂结构、催化剂-表面电解质动力学和局部瞬态产物形成。它还强调了这些技术的基本原理,对推进OOR应用的未来前景和挑战提出了展望,特别是在发现下一代高效催化剂方面。
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引用次数: 0
Transition metal complexes as optical probes for super-resolution microscopy 过渡金属配合物作为超分辨显微镜的光学探针。
IF 51.7 1区 化学 Q1 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2025-10-16 DOI: 10.1038/s41570-025-00764-w
Sumit Kumar Pramanik, Sreejesh Sreedharan, Noufal Kandoth, Jorge Bernardino de la Serna, Amitava Das, Jim A. Thomas
The suite of techniques encompassing optical super-resolution microscopy can facilitate detailed visualization of biological structures and biochemical transformations at unprecedented levels of resolution and contrast; however, they depend on imaging probes with specific biophysical and photophysical properties. In this context, metal complexes with tuneable photo-excited states and stability towards photobleaching are promising candidates for advanced imaging techniques. This Review illustrates how, by selecting appropriate optical properties and luminescence responses, metal complexes can be utilized as probes for a range of super-resolution microscopy techniques, including multimodal imaging, to study subcellular architecture and dynamics with nanoscale resolution. Limitations and challenges of the existing molecular probes are also discussed. By highlighting these recent innovations and providing suggestions for future directions, this Review further underscores the importance of optical probes in pushing the boundaries of super-resolution microscopy and advancing our understanding of complex biological systems. Super-resolution microscopy techniques can break conventional optical diffraction limits, but their performance can only be optimized by using probes with appropriate biophysical and photophysical properties. This Review highlights how transition metal complexes are being designed to meet these challenges.
包括光学超分辨率显微镜在内的一系列技术可以以前所未有的分辨率和对比度水平促进生物结构和生化转化的详细可视化;然而,它们依赖于具有特定生物物理和光物理性质的成像探针。在这种情况下,具有可调谐光激发态和光漂白稳定性的金属配合物是先进成像技术的有希望的候选者。这篇综述阐述了如何通过选择适当的光学性质和发光响应,金属配合物可以用作一系列超分辨率显微镜技术的探针,包括多模态成像,以纳米级分辨率研究亚细胞结构和动力学。讨论了现有分子探针的局限性和挑战。通过强调这些最新的创新和对未来方向的建议,本综述进一步强调了光学探针在推动超分辨率显微镜的边界和促进我们对复杂生物系统的理解方面的重要性。
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引用次数: 0
Bringing geopolitics to the periodic table 将地缘政治纳入元素周期表。
IF 51.7 1区 化学 Q1 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2025-10-13 DOI: 10.1038/s41570-025-00766-8
João Avó, Carina I. C. Crucho
The periodic table is not only a foundational tool of chemistry, but also a strategic map of the elements. Here we trace how the value of elements has shifted through history — shaping war, trade, and diplomacy — and call for consideration on how to manage growing global competition over critical materials.
元素周期表不仅是化学的基础工具,而且是元素的战略地图。在这里,我们追溯了元素的价值在历史上是如何变化的——塑造了战争、贸易和外交——并呼吁考虑如何管理对关键材料日益增长的全球竞争。
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引用次数: 0
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Nature reviews. Chemistry
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