Skip to content

Commit

Permalink
Update README.md
Browse files Browse the repository at this point in the history
  • Loading branch information
hcji committed Feb 8, 2022
1 parent 0dacdf8 commit ebd5010
Showing 1 changed file with 17 additions and 1 deletion.
18 changes: 17 additions & 1 deletion README.md
Original file line number Diff line number Diff line change
Expand Up @@ -77,7 +77,23 @@ There are many types of chemical fingerprint for describing the molecule provide

### Cite

[Predicting Molecular Fingerprint from Electron-Ionization Mass Spectrum with Deep Neural Networks](https://pubs.acs.org/doi/10.1021/acs.analchem.0c01450)

```bibtex
@article{doi:10.1021/acs.analchem.0c01450,
author = {Ji, Hongchao and Deng, Hanzi and Lu, Hongmei and Zhang, Zhimin},
title = {Predicting a Molecular Fingerprint from an Electron Ionization Mass Spectrum with Deep Neural Networks},
journal = {Analytical Chemistry},
volume = {92},
number = {13},
pages = {8649-8653},
year = {2020},
doi = {10.1021/acs.analchem.0c01450},
note ={PMID: 32584545},
URL = {
https://doi.org/10.1021/acs.analchem.0c01450
}}
```

### Support fingerprint types:

Expand Down

0 comments on commit ebd5010

Please sign in to comment.