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Machine Learning in Bio-cheminformatics
Submit your manuscript for consideration in the journal’s upcoming Special Issue, “Machine Learning in Bio-cheminformatics,” by August 1, 2023. To learn more about this Special Issue, read this recently published Editorial.

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Harnessing the Power of Large Language Model-Based Chatbots for Scientific Discovery
This Virtual Special Issue will foster further discussion on appropriate applications of Chatbots in the chemical, pharmaceutical, material, and biological sciences. Submit your manuscript by August 1, 2024.
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AlphaFold2 in Molecular Discovery
Since its inception, AlphaFold2 (AF2) has revolutionized how scientists predict the structure of proteins. This Virtual Issue highlights how AF2 is used in computational chemistry for myriad applications ranging from drug discovery to predicting protein functions.

Special Issue
This Special Issue contains a combination of articles that merge experimental work and chemical information and modeling, or purely theoretical work. The articles cover broad aspects of computational and theoretical chemistry and perspectives on diversity, equity, inclusion, and respect, with a particular eye on the advancement of women in chemistry.

Special Issue
From Reaction Informatics to Chemical Space
Discover exciting developments in cheminformatics. Several papers deal with the generation of new chemical structures applying modern machine learning techniques. Read the Special Issue to learn more.
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