View in EDS

Finding Thermodynamically Favorable Pathways in Chemical Reaction Networks Using Flows in Hypergraphs and Mixed-Integer Linear Programming.

Saved in:
Bibliographic Details
Title: Finding Thermodynamically Favorable Pathways in Chemical Reaction Networks Using Flows in Hypergraphs and Mixed-Integer Linear Programming.
Authors: Pal A; Department of Mathematics and Computer Science, University of Southern Denmark, Campusvej 55, 5230 Odense M, Denmark., Fagerberg R; Department of Mathematics and Computer Science, University of Southern Denmark, Campusvej 55, 5230 Odense M, Denmark., Andersen JL; Department of Mathematics and Computer Science, University of Southern Denmark, Campusvej 55, 5230 Odense M, Denmark., Flamm C; Department of Theoretical Chemistry, University of Vienna, Währinger Straße 17, 1090 Wien, Austria., Dittrich P; Department of Mathematics and Computer Science, Friedrich Schiller University Jena, Fürstengraben, 07743 Jena, Germany., Merkle D; Department of Mathematics and Computer Science, University of Southern Denmark, Campusvej 55, 5230 Odense M, Denmark.; Faculty of Technology, Bielefeld University, Postfach 10 01 31, 33501 Bielefeld, Germany.
Source: Journal of chemical information and modeling [J Chem Inf Model] 2025 Jul 14; Vol. 65 (13), pp. 6772-6787. Date of Electronic Publication: 2025 Jun 10.
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
Header DbId: mdl
DbLabel: MEDLINE Ultimate
An: 40493471
AccessLevel: 2
PubType: Academic Journal
PubTypeId: academicJournal
PreciseRelevancyScore: 0
IllustrationInfo
Items – Name: Title
  Label: Title
  Group: Ti
  Data: Finding Thermodynamically Favorable Pathways in Chemical Reaction Networks Using Flows in Hypergraphs and Mixed-Integer Linear Programming.
– Name: Author
  Label: Authors
  Group: Au
  Data: <searchLink fieldCode="AU" term="%22Pal+A%22">Pal A</searchLink>; Department of Mathematics and Computer Science, University of Southern Denmark, Campusvej 55, 5230 Odense M, Denmark.<br /><searchLink fieldCode="AU" term="%22Fagerberg+R%22">Fagerberg R</searchLink>; Department of Mathematics and Computer Science, University of Southern Denmark, Campusvej 55, 5230 Odense M, Denmark.<br /><searchLink fieldCode="AU" term="%22Andersen+JL%22">Andersen JL</searchLink>; Department of Mathematics and Computer Science, University of Southern Denmark, Campusvej 55, 5230 Odense M, Denmark.<br /><searchLink fieldCode="AU" term="%22Flamm+C%22">Flamm C</searchLink>; Department of Theoretical Chemistry, University of Vienna, Währinger Straße 17, 1090 Wien, Austria.<br /><searchLink fieldCode="AU" term="%22Dittrich+P%22">Dittrich P</searchLink>; Department of Mathematics and Computer Science, Friedrich Schiller University Jena, Fürstengraben, 07743 Jena, Germany.<br /><searchLink fieldCode="AU" term="%22Merkle+D%22">Merkle D</searchLink>; Department of Mathematics and Computer Science, University of Southern Denmark, Campusvej 55, 5230 Odense M, Denmark.; Faculty of Technology, Bielefeld University, Postfach 10 01 31, 33501 Bielefeld, Germany.
– Name: TitleSource
  Label: Source
  Group: Src
  Data: <searchLink fieldCode="JN" term="%22101230060%22">Journal of chemical information and modeling</searchLink> [J Chem Inf Model] 2025 Jul 14; Vol. 65 (13), pp. 6772-6787. <i>Date of Electronic Publication: </i>2025 Jun 10.
– 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=40493471
RecordInfo BibRecord:
  BibEntity:
    Identifiers:
      – Type: doi
        Value: 10.1021/acs.jcim.5c00265
    Languages:
      – Code: eng
        Text: English
    PhysicalDescription:
      Pagination:
        StartPage: 6772
    Titles:
      – TitleFull: Finding Thermodynamically Favorable Pathways in Chemical Reaction Networks Using Flows in Hypergraphs and Mixed-Integer Linear Programming.
        Type: main
  BibRelationships:
    HasContributorRelationships:
      – PersonEntity:
          Name:
            NameFull: Pal A
      – PersonEntity:
          Name:
            NameFull: Fagerberg R
      – PersonEntity:
          Name:
            NameFull: Andersen JL
      – PersonEntity:
          Name:
            NameFull: Flamm C
      – PersonEntity:
          Name:
            NameFull: Dittrich P
      – PersonEntity:
          Name:
            NameFull: Merkle D
    IsPartOfRelationships:
      – BibEntity:
          Dates:
            – D: 14
              M: 07
              Text: 2025 Jul 14
              Type: published
              Y: 2025
          Identifiers:
            – Type: issn-electronic
              Value: 1549-960X
          Numbering:
            – Type: volume
              Value: 65
            – Type: issue
              Value: 13
          Titles:
            – TitleFull: Journal of chemical information and modeling
              Type: main
ResultId 1