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Overview
Journal of Cheminformatics is a fully open access journal publishing original peer-reviewed research in all aspects of cheminformatics. Coverage includes, but is not limited to:
- chemical information systems, software and databases, and method development for molecular modelling
- chemical structure representations and their use in structure, substructure, and similarity searching of chemical substance and chemical reaction databases
- computer and molecular graphics, computer-aided molecular design, expert systems, QSAR, and data mining techniques
Journal of Cheminformatics is lead by an esteemed editorial team of global recognized scientists specializing in cheminformatics. The journal is well indexed by CAS, DOAJ, Scopus, SCIE, PubMed Central, etc.
- Editors-in-Chief
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- Karina Martínez-Mayorga,
- Barbara Zdrazil
- Associate Editors
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- Neil Berry,
- Gian Marco Ghiandoni,
- Antonella Di Pizio,
- Igor V. Tetko,
- Yufeng Jane Tseng
Journal metrics
- Journal Impact Factor
- 5.7 (2024)
- 5-year Journal Impact Factor
- 8.9 (2024)
- Submission to first decision (median)
- 9 days
- Downloads
- 1.6M (2024)
Journal highlights
Update
Featured collections
View the latest special collections of the journal: 1) Milestones in Cheminformatics; 2) AI in Drug Discovery.
Article
How to crack a SMILES: automatic crosschecked chemical structure resolution across multiple services using MoleculeResolver
Abstract Accurate chemical structure resolution from textual identifiers such as names and CAS RN® is critical for computational modeling in chemistry and related fields. This p…
Calls for papers
Collection
Evaluating AI and machine learning models in cheminformatics: benchmarking techniques and case studies
Journal of Cheminformatics is inviting submissions for a collection on "Evaluating AI and machine learning models in cheminformatics: benchmarking...
- Status
- Open for submissions
- Submission deadline
- 16 April 2026
Collection
Research from the 13th International Conference on Chemical Structures
The 13th International Conference on Chemical Structures (ICCS 2025) will take place on June 1-5, 2025, in Noordwijkerhout, The Netherlands, where...
- Status
- Open for submissions
- Submission deadline
- 01 March 2026
Latest articles
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A comprehensive evaluation of advanced methods for identifying structural alerts using extensive toxicity data
- Ning-Ning Wang
- Yuan-Hang He
- Dong-Sheng Cao
Research Open access 30 January 2026
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Chemical genomics language model toward reliable and explainable compound-protein interaction exploration
- Takuto Koyama
- Hayato Tsumura
- Yasushi Okuno
Research Open access 30 January 2026 -
Advancing chemical safety prediction: an integrated GNN framework with DFT-augmented cyclic compound solution
- Seul Lee
- Jooyeon Lee
- Keunhong Jeong
Research Open access 28 January 2026 -
STRIKER: a spectral metadata repairing tool for expanding the comprehensiveness of spectral libraries
- Ahmed Karam
- Asmaa Ramzy
- Sameh Magdeldin
Software Open access 27 January 2026 -
Paths to cheminformatics: Q&A with Rajarshi Guha
- Rajarshi Guha
Question & Answer Open access 20 January 2026 Article: 9
Journal updates
-
Featured collections
View the latest special collections of the journal:
1) Milestones in Cheminformatics;
2) AI in Drug Discovery.
-
Journal announcements
Here you can find news and announcements relating to the Journal of Cheminformatics.
Benefit from our free funding service
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Latest Tweets
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Journal information
- Electronic ISSN
- 1758-2946
- Abstracted and indexed in
-
- Baidu
- CLOCKSS
- CNKI
- CNPIEC
- Chemical Abstracts Service (CAS)
- Chinese Academy of Medical Science (CAMS)
- DBLP
- DOAJ
- Dimensions
- EBSCO
- Gale
- GoOA - The Chinese Academy of Sciences (CAS)
- Google Scholar
- Japanese Science and Technology Agency (JST)
- Naver
- OCLC WorldCat Discovery Service
- Portico
- ProQuest
- PubMedCentral
- SCImago
- SCOPUS
- Science Citation Index Expanded (SCIE)
- Semantic Scholar
- TD Net Discovery Service
- Wanfang
- eLibrary.ru
- © Springer Nature Switzerland AG