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Illuminating the Interface of Blocc Chemistry and Data Science: Maximizing Function with ML-Guided Discovery and a Digital Molecule Maker.

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Title: Illuminating the Interface of Blocc Chemistry and Data Science: Maximizing Function with ML-Guided Discovery and a Digital Molecule Maker.
Authors: Green NM; Department of Chemistry, University of Illinois, Urbana, Illinois 61801, United States., Hammond RI; Department of Chemistry, University of Illinois, Urbana, Illinois 61801, United States., Planey J; IMMERSE: Center for Immersive Computing, University of Illinois, Urbana, Illinois 61801, United States., Angello NH; Department of Chemistry, University of Illinois, Urbana, Illinois 61801, United States., Putnam JLB; College of Education, University of Illinois, Urbana, Illinois 61801, United States., Berry M; National Center for Supercomputing Applications, Urbana, Illinois 61801, United States., He W; National Center for Supercomputing Applications, Urbana, Illinois 61801, United States., Chen E; Siebel Center for Design, University of Illinois, Urbana, Illinois 61801, United States., Nuñez-Corrales S; National Center for Supercomputing Applications, Urbana, Illinois 61801, United States., Loving DC; Department of Chemistry, University of Illinois, Urbana, Illinois 61801, United States., Wang W; Department of Chemistry, University of Illinois, Urbana, Illinois 61801, United States., Huang T; Department of Chemistry, University of Illinois, Urbana, Illinois 61801, United States., Gunasekera B; Department of Chemistry, University of Illinois, Urbana, Illinois 61801, United States., Marville K; Department of Chemistry, University of Illinois, Urbana, Illinois 61801, United States., Switzky R; Department of Chemistry, University of Illinois, Urbana, Illinois 61801, United States., Desmond S; Department of Chemistry, University of Illinois, Urbana, Illinois 61801, United States., Burke MD; Department of Chemistry, University of Illinois, Urbana, Illinois 61801, United States.
Source: Journal of chemical education [J Chem Educ] 2025 Nov 06; Vol. 103 (2), pp. 976-985. Date of Electronic Publication: 2025 Nov 06 (Print Publication: 2026).
Publication Type: Journal Article
Journal Info: Publisher: American Chemical Society. Division Of Chemical Education Country of Publication: United States NLM ID: 2985122R Publication Model: eCollection Cited Medium: Print ISSN: 0021-9584 (Print) Linking ISSN: 00219584 NLM ISO Abbreviation: J Chem Educ Subsets: PubMed not MEDLINE
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