OpenADMET · CYP Challenge

Updated

Data · cofolding structures

CYP cofolding structures

We generated an aligned structure set to support structural feature work.

16,739structure rows
149experimental structures
16,590predicted structures
5prediction methods

Why we made it

We want to test whether structural features add useful information to the CYP models. The files are aligned to make those comparisons easier.

Checks

Every structure passed the release parser. The release table, paths, and hashes also passed their checks.

Get the data

Open the dataset on Hugging FaceDataset card, Parquet table, aligned coordinates, QC fields, checksums, and provenance.

Interpretation

These structures are hypotheses, not inhibition measurements. They also do not describe the full mechanism of time-dependent inhibition.