molforge

Here is 1 public repository matching this topic...

NilsDunlop / Flip2Mol

A data science project completed in collaboration with AstraZeneca as part of the course DIT892. The project focused on analyzing ECFP4 fingerprint bit flipping as a method for identifying nearby and novel molecular structures.

ai rdkit molecules ecfp4 bit-flipping molforge

Updated Feb 8, 2025
Jupyter Notebook

Improve this page

Add a description, image, and links to the molforge topic page so that developers can more easily learn about it.

Curate this topic

Add this topic to your repo

To associate your repository with the molforge topic, visit your repo's landing page and select "manage topics."

Learn more

Provide feedback

Saved searches

Use saved searches to filter your results more quickly

molforge

Here is 1 public repository matching this topic...

NilsDunlop / Flip2Mol

Improve this page

Add this topic to your repo