The Journal of Molecular Modeling focuses on "hardcore" modeling, publishing high-quality research and reports. Founded in 1995 as a purely electronic journal, it has adapted its format to include a full-color print edition, and adjusted its aims and scope fit the fast-changing field of molecular modeling, with a particular focus on three-dimensional modeling.

Today, the journal covers all aspects of molecular modeling including life science modeling; materials modeling; new methods; and computational chemistry.

Topics include computer-aided molecular design; rational drug design, de novo ligand design, receptor modeling and docking; cheminformatics, data analysis, visualization and mining; computational medicinal chemistry; homology modeling; simulation of peptides, DNA and other biopolymers; quantitative structure-activity relationships (QSAR) and ADME-modeling; modeling of biological reaction mechanisms; and combined experimental and computational studies in which calculations play a major role.

Cover : The cover design is based on graphics designed and computed by Prof. J. Brickmann, Molcad GmbH, Darmstadt, Germany.

  • Covers all aspects of molecular modeling and its application
  • Focuses on "hardcore" modeling, publishing high-quality research and reports
  • Topics include life science modeling; materials modeling; new methods; and computational chemistry

Journal information

Editor-in-Chief
  • Timothy Clark
Publishing model
Hybrid. Open Access options available

Journal metrics

1.335 (2018)
Impact factor
1.423 (2018)
Five year impact factor
36 days
Submission to first decision
128 days
Submission to acceptance
241,371 (2018)
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About this journal

Electronic ISSN
0948-5023
Print ISSN
1610-2940
Abstracted and indexed in
  1. AGRICOLA
  2. CAB Abstracts
  3. CNKI
  4. Chemical Abstracts Service (CAS)
  5. Current Contents/ Life Sciences
  6. Current Contents/Physical, Chemical and Earth Sciences
  7. EBSCO Academic Search
  8. EBSCO Biomedical Reference Collection
  9. EBSCO Discovery Service
  10. EBSCO STM Source
  11. EMBASE
  12. EMBiology
  13. Gale
  14. Gale Academic OneFile
  15. Gale InfoTrac
  16. Google Scholar
  17. Institute of Scientific and Technical Information of China
  18. Japanese Science and Technology Agency (JST)
  19. Journal Citation Reports/Science Edition
  20. Medline
  21. Naver
  22. OCLC WorldCat Discovery Service
  23. Pathway Studio
  24. ProQuest Central
  25. ProQuest Materials Science and Engineering Database
  26. ProQuest SciTech Premium Collection
  27. ProQuest Technology Collection
  28. ProQuest-ExLibris Primo
  29. ProQuest-ExLibris Summon
  30. Reaxys
  31. SCImago
  32. SCOPUS
  33. Science Citation Index Expanded (SciSearch)
  34. Semantic Scholar
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