聚合物的计算机辅助自动流动化学合成

IF 5.4 1区 化学 Q2 CHEMISTRY, MULTIDISCIPLINARY
GIANT Pub Date : 2024-03-15 DOI:10.1016/j.giant.2024.100252
Li Yu , Baiyang Chen , Ziying Li , Yue Su , Xuesong Jiang , Zeguang Han , Yongfeng Zhou , Deyue Yan , Xinyuan Zhu , Ruijiao Dong
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引用次数: 0

摘要

在过去的一个世纪里,合成化学在人类文明的各个领域发挥了重要作用。然而,合成阶段仍然耗时耗力。为了克服这些局限性,人们引入了自动化技术来改变合成化学,从而开发出用于分子发现的高通量方法。与众所周知的自动化固相肽合成相比,自动化流动化学合成(AFCS)具有更高的效率、可扩展性和可持续性,最近已成为一种有前途的候选方法。为了进一步推动 AFCS 的发展,可以考虑采用基于人工智能的计算机辅助结构设计和合成规划、具有增强型自动过程控制功能的自主组装兼容合成以及自主优化等要素。本综述重点介绍活聚合和迭代合成策略中聚合物计算机辅助自动流动化学合成(CAAFCS)的最新进展。最后讨论了当前的挑战和前景,以开发功能更强大的 CAAFCS 系统,并扩大其在众多领域的适用性,从而为该领域的未来发展提供全新的视角和指导方针。
本文章由计算机程序翻译,如有差异,请以英文原文为准。

Computer-aided automated flow chemical synthesis of polymers

Computer-aided automated flow chemical synthesis of polymers

Synthetic chemistry has played a vital role in miscellaneous fields of human civilization over the past century. The synthetic stage yet remains time-consuming and labor-intensive. To overcome these limitations, automation has been introduced to transform synthetic chemistry, leading to the development of high-throughput methods for molecular discovery. Automated flow chemical synthesis (AFCS) has recently emerged as a promising candidate, offering improved efficiency, scalability, and sustainability over the well-known automated solid-phase peptide synthesis. To further advance AFCS, elements like artificial intelligence-based computer-aided structure design and synthesis planning, autonomously assembled compatible synthesis with enhanced automated process control, and autonomous optimization can be considered. This review focuses on recent advances in computer-aided automated flow chemical synthesis (CAAFCS) of polymers in living polymerization and iterative synthesis strategy. The current challenges and outlook are finally discussed for developing more powerful CAAFCS systems and expanding their applicability across numerous fields, potentially providing brand-new perspectives and guidelines for future developments in this field.

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来源期刊
GIANT
GIANT Multiple-
CiteScore
8.50
自引率
8.60%
发文量
46
审稿时长
42 days
期刊介绍: Giant is an interdisciplinary title focusing on fundamental and applied macromolecular science spanning all chemistry, physics, biology, and materials aspects of the field in the broadest sense. Key areas covered include macromolecular chemistry, supramolecular assembly, multiscale and multifunctional materials, organic-inorganic hybrid materials, biophysics, biomimetics and surface science. Core topics range from developments in synthesis, characterisation and assembly towards creating uniformly sized precision macromolecules with tailored properties, to the design and assembly of nanostructured materials in multiple dimensions, and further to the study of smart or living designer materials with tuneable multiscale properties.
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