Inverse Design of Metal-Organic Polyhedra through Molecular Fragmentation and Evolutionary Optimisation.
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| Title: | Inverse Design of Metal-Organic Polyhedra through Molecular Fragmentation and Evolutionary Optimisation. |
|---|---|
| Authors: | Butler PWV; Department of Chemical Engineering and Biotechnology, University of Cambridge, Philippa Fawcett Drive, Cambridge CB3 0AS, U.K., Rihm SD; Department of Chemical Engineering and Biotechnology, University of Cambridge, Philippa Fawcett Drive, Cambridge CB3 0AS, U.K., Mosbach S; Department of Chemical Engineering and Biotechnology, University of Cambridge, Philippa Fawcett Drive, Cambridge CB3 0AS, U.K.; CARES, Cambridge Centre for Advanced Research and Education in Singapore, 1 Create Way, CREATE Tower, #05-05, Singapore 138602, Singapore., Akroyd J; Department of Chemical Engineering and Biotechnology, University of Cambridge, Philippa Fawcett Drive, Cambridge CB3 0AS, U.K.; CARES, Cambridge Centre for Advanced Research and Education in Singapore, 1 Create Way, CREATE Tower, #05-05, Singapore 138602, Singapore., Kraft M; Department of Chemical Engineering and Biotechnology, University of Cambridge, Philippa Fawcett Drive, Cambridge CB3 0AS, U.K.; CARES, Cambridge Centre for Advanced Research and Education in Singapore, 1 Create Way, CREATE Tower, #05-05, Singapore 138602, Singapore.; MIT, Chemical Engineering, 77 Massachusetts Avenue, Room E17-504, Cambridge, Massachusetts 02139, United States. |
| Source: | Journal of chemical information and modeling [J Chem Inf Model] 2026 Apr 13; Vol. 66 (7), pp. 3933-3943. Date of Electronic Publication: 2026 Apr 01. |
| Publication Type: | Journal Article |
| Journal Info: | Publisher: American Chemical Society Country of Publication: United States NLM ID: 101230060 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1549-960X (Electronic) Linking ISSN: 15499596 NLM ISO Abbreviation: J Chem Inf Model Subsets: MEDLINE |
| Database: | MEDLINE Ultimate |
| FullText | Text: Availability: 0 |
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| Header | DbId: mdl DbLabel: MEDLINE Ultimate An: 41922190 AccessLevel: 2 PubType: Academic Journal PubTypeId: academicJournal PreciseRelevancyScore: 0 |
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| Items | – Name: Title Label: Title Group: Ti Data: Inverse Design of Metal-Organic Polyhedra through Molecular Fragmentation and Evolutionary Optimisation. – Name: Author Label: Authors Group: Au Data: <searchLink fieldCode="AU" term="%22Butler+PWV%22">Butler PWV</searchLink>; Department of Chemical Engineering and Biotechnology, University of Cambridge, Philippa Fawcett Drive, Cambridge CB3 0AS, U.K.<br /><searchLink fieldCode="AU" term="%22Rihm+SD%22">Rihm SD</searchLink>; Department of Chemical Engineering and Biotechnology, University of Cambridge, Philippa Fawcett Drive, Cambridge CB3 0AS, U.K.<br /><searchLink fieldCode="AU" term="%22Mosbach+S%22">Mosbach S</searchLink>; Department of Chemical Engineering and Biotechnology, University of Cambridge, Philippa Fawcett Drive, Cambridge CB3 0AS, U.K.; CARES, Cambridge Centre for Advanced Research and Education in Singapore, 1 Create Way, CREATE Tower, #05-05, Singapore 138602, Singapore.<br /><searchLink fieldCode="AU" term="%22Akroyd+J%22">Akroyd J</searchLink>; Department of Chemical Engineering and Biotechnology, University of Cambridge, Philippa Fawcett Drive, Cambridge CB3 0AS, U.K.; CARES, Cambridge Centre for Advanced Research and Education in Singapore, 1 Create Way, CREATE Tower, #05-05, Singapore 138602, Singapore.<br /><searchLink fieldCode="AU" term="%22Kraft+M%22">Kraft M</searchLink>; Department of Chemical Engineering and Biotechnology, University of Cambridge, Philippa Fawcett Drive, Cambridge CB3 0AS, U.K.; CARES, Cambridge Centre for Advanced Research and Education in Singapore, 1 Create Way, CREATE Tower, #05-05, Singapore 138602, Singapore.; MIT, Chemical Engineering, 77 Massachusetts Avenue, Room E17-504, Cambridge, Massachusetts 02139, United States. – Name: TitleSource Label: Source Group: Src Data: <searchLink fieldCode="JN" term="%22101230060%22">Journal of chemical information and modeling</searchLink> [J Chem Inf Model] 2026 Apr 13; Vol. 66 (7), pp. 3933-3943. <i>Date of Electronic Publication: </i>2026 Apr 01. – Name: TypePub Label: Publication Type Group: TypPub Data: Journal Article – Name: TitleSource Label: Journal Info Group: Src Data: <i>Publisher: </i><searchLink fieldCode="PB" term="%22American+Chemical+Society%22">American Chemical Society </searchLink><i>Country of Publication: </i>United States <i>NLM ID: </i>101230060 <i>Publication Model: </i>Print-Electronic <i>Cited Medium: </i>Internet <i>ISSN: </i>1549-960X (Electronic) <i>Linking ISSN: </i><searchLink fieldCode="IS" term="%2215499596%22">15499596 </searchLink><i>NLM ISO Abbreviation: </i>J Chem Inf Model <i>Subsets: </i>MEDLINE |
| PLink | https://search.ebscohost.com/login.aspx?direct=true&site=eds-live&db=mdl&AN=41922190 |
| RecordInfo | BibRecord: BibEntity: Identifiers: – Type: doi Value: 10.1021/acs.jcim.5c02956 Languages: – Code: eng Text: English PhysicalDescription: Pagination: StartPage: 3933 Titles: – TitleFull: Inverse Design of Metal-Organic Polyhedra through Molecular Fragmentation and Evolutionary Optimisation. Type: main BibRelationships: HasContributorRelationships: – PersonEntity: Name: NameFull: Butler PWV – PersonEntity: Name: NameFull: Rihm SD – PersonEntity: Name: NameFull: Mosbach S – PersonEntity: Name: NameFull: Akroyd J – PersonEntity: Name: NameFull: Kraft M IsPartOfRelationships: – BibEntity: Dates: – D: 13 M: 04 Text: 2026 Apr 13 Type: published Y: 2026 Identifiers: – Type: issn-electronic Value: 1549-960X Numbering: – Type: volume Value: 66 – Type: issue Value: 7 Titles: – TitleFull: Journal of chemical information and modeling Type: main |
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