Supramolecular Chemistry: Prediction, Synthesis and Catalysis

Dear Colleagues,

Supramolecular chemistry, which explores the structures and functions of molecular assemblies formed through non-covalent interactions, stands at the forefront of modern chemical research. This field advances our understanding of molecular recognition and self-assembly while also paving the way for innovative applications in catalysis, materials science, and biochemistry. Emphasizing weak intermolecular interactions, such as hydrogen bonding, π-π interactions, metal coordination, and hydrophobic effects, it enables the design of highly selective catalysts, the development of new materials, and advancements in molecular recognition and signal transduction in medicine.

In recent years, with the advancement of computational chemistry and machine learning technologies, predictive methods in supramolecular chemistry have also undergone significant development. Scientists can use advanced computational tools to predict the structures and functions of supramolecular systems, thereby guiding experimental design and the development of new materials. At the same time, innovations in synthetic techniques have enabled the realization of complex supramolecular structures in the laboratory, providing the opportunity to study their properties and applications.

Supramolecular catalysis, as a key application in this field, has shown tremendous potential. Precisely designed supramolecular catalysts can efficiently promote chemical reactions under mild conditions, reducing energy consumption and byproduct formation, which is in line with the principles of green chemistry. This holds significant importance not only in fundamental chemical research but also in applied fields such as pharmaceutical synthesis, industrial production, and environmental protection.

We warmly invite scientists and researchers worldwide to submit their latest research findings, reviews, and perspectives on the aspects of prediction, synthesis, and catalysis in supramolecular chemistry. This call for papers aims to showcase cutting-edge research in the field of supramolecular chemistry and promote academic exchange and collaboration.

Topics of interest include, but are not limited to:

• Design, synthesis, and characterization of supramolecular catalysts;
• Mechanistic studies of supramolecular catalysis;
• Applications of supramolecular catalysis in organic synthesis;
• Computational modeling in supramolecular catalysis;
• Sustainability and environmental impact of supramolecular catalysis;
• Exploration of novel supramolecular systems in catalysis.

This Special Issue aims to showcase frontiers in supramolecular catalysis research and foster academic exchange and collaboration in this field. We welcome submissions from researchers with diverse academic backgrounds, especially those involved with innovative and interdisciplinary studies. All submitted manuscripts will undergo rigorous peer review to ensure their high quality and scientific integrity.

We eagerly anticipate your contributions and look forward to advancing the field of supramolecular chemistry together.

Dr. Wanlu Li
Prof. Dr. Liping Xu
Guest Editors

Manuscript Submission Information

Manuscripts should be submitted online at www.mdpi.com by registering and logging in to this website. Once you are registered, click here to go to the submission form. Manuscripts can be submitted until the deadline. All submissions that pass pre-check are peer-reviewed. Accepted papers will be published continuously in the journal (as soon as accepted) and will be listed together on the special issue website. Research articles, review articles as well as short communications are invited. For planned papers, a title and short abstract (about 100 words) can be sent to the Editorial Office for announcement on this website.

Submitted manuscripts should not have been published previously, nor be under consideration for publication elsewhere (except conference proceedings papers). All manuscripts are thoroughly refereed through a single-blind peer-review process. A guide for authors and other relevant information for submission of manuscripts is available on the Instructions for Authors page. Inorganics is an international peer-reviewed open access monthly journal published by MDPI.

Please visit the Instructions for Authors page before submitting a manuscript. The Article Processing Charge (APC) for publication in this open access journal is 2700 CHF (Swiss Francs). Submitted papers should be well formatted and use good English. Authors may use MDPI's English editing service prior to publication or during author revisions.

• supramolecular catalysis
• molecular recognition
• non-covalent interactions
• predictive modeling
• host-guest complexes