Skip to content
New issue

Have a question about this project? Sign up for a free GitHub account to open an issue and contact its maintainers and the community.

By clicking “Sign up for GitHub”, you agree to our terms of service and privacy statement. We’ll occasionally send you account related emails.

Already on GitHub? Sign in to your account

Decode fingerprint #21

Closed

Conversation

RickardSjogren
Copy link
Contributor

The fingerprint provided was the raw hex-string obtained through the REST API. I added decoding of the hex string according to the documentation at ftp://ftp.ncbi.nlm.nih.gov/pubchem/specifications/pubchem_fingerprints.txt

Now Compound.fingerprint returns the 881 bit fingerprint which can be used directly for similarity comparisons.

@mcs07
Copy link
Owner

mcs07 commented Apr 10, 2017

Superseded by #22

@mcs07 mcs07 closed this Apr 10, 2017
@RickardSjogren RickardSjogren deleted the decode-fingerprint branch April 11, 2017 05:45
Sign up for free to join this conversation on GitHub. Already have an account? Sign in to comment
Labels
None yet
Projects
None yet
Development

Successfully merging this pull request may close these issues.

2 participants