The Journal of Computer-Aided Molecular Design provides a forum for disseminating information on both the theory and the application of computer-based methods in the analysis and design of molecules. The scope of the journal encompasses papers which report new and original research and applications in the following areas:
  • theoretical chemistry
  • computational chemistry
  • computer and molecular graphics
  • molecular modeling
  • protein engineering
  • drug design
  • expert systems
  • general structure-property relationships
  • molecular dynamics
  • chemical database development and usage
Contributions on computer-aided molecular modeling studies in pharmaceutical, polymer, materials and surface sciences, as well as other molecular-based disciplines, are particularly welcome.

Journal information

Editors-in-Chief
  • Federico Gago,
  • Terry R. Stouch,
  • Richard Lewis
Publishing model
Hybrid (Transformative Journal). How to publish with us, including Open Access

Journal metrics

4.179 (2021)
Impact factor
3.897 (2021)
Five year impact factor
27 days
Submission to first decision (Median)
246,572 (2021)
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About this journal

Electronic ISSN
1573-4951
Print ISSN
0920-654X
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