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Journal of Cheminformatics is a peer-reviewed journal published by BMC (BioMed Central), covering Computational Drug Discovery Methods, Machine Learning in Materials Science, Protein Structure and Dynamics. Over its lifetime it has published 1,853 papers, which have received 103,798 citations.
| Publisher | BMC (BioMed Central) |
|---|---|
| Reference style | Numbered (Vancouver) Numbered — [1], [2] in the text 1. Smith A, Jones B, Lee C. A representative article title. Journal of Cheminformatics. 2023;12(3):45–58.
Formats any DOI in Journal of Cheminformatics style. No sign-up. |
| Publishes research in | Computational Drug Discovery Methods Machine Learning in Materials Science Protein Structure and Dynamics Metabolomics and Mass Spectrometry Studies Analytical Chemistry and Chromatography |
| ISSN | 1758-2946 |
| Citation impact (2-yr) | 7.47 |
| h-index | 121 |
| i10-index | 943 |
| Article processing charge | $1,582 |
| Open access | Yes — indexed in DOAJ |
| Top institutions publishing here | University of Cambridge |
| Journal website | jcheminf.springeropen.com |
| You get | A submission-ready PDF and the editable LaTeX source — ready to submit. |
Citations each year’s papers have accumulated so far — the most recent years are still building up.
BACKGROUND: A frequent problem in computational modeling is the interconversion of chemical structures between different formats. While standard interchange formats exist (for example, Chemical Markup Language) and de facto standards have arisen (for example, SMILES format), the need to interconvert formats is a continuing problem due to the multitude of different application areas for chemistry…
BACKGROUND: The Avogadro project has developed an advanced molecule editor and visualizer designed for cross-platform use in computational chemistry, molecular modeling, bioinformatics, materials science, and related areas. It offers flexible, high quality rendering, and a powerful plugin architecture. Typical uses include building molecular structures, formatting input files, and analyzing output of a wide variety of…
BACKGROUND: Modern medicine often clashes with traditional medicine such as Chinese herbal medicine because of the little understanding of the underlying mechanisms of action of the herbs. In an effort to promote integration of both sides and to accelerate the drug discovery from herbal medicines, an efficient systems pharmacology platform that represents ideal information convergence…
BACKGROUND: A method to estimate ease of synthesis (synthetic accessibility) of drug-like molecules is needed in many areas of the drug discovery process. The development and validation of such a method that is able to characterize molecule synthetic accessibility as a score between 1 (easy to make) and 10 (very difficult to make) is described…
BACKGROUND: Cheminformaticians are equipped with a very rich toolbox when carrying out molecular similarity calculations. A large number of molecular representations exist, and there are several methods (similarity and distance metrics) to quantify the similarity of molecular representations. In this work, eight well-known similarity/distance metrics are compared on a large dataset of molecular fingerprints with…
