README_CELL5.md

metadata

tags:
  - kluyveromyces-marxianus
  - cell5
  - metabolomics
  - compounds
  - v10.0.0

🌌 Cell 5: Quantum Metabolomics & Compounds

This README documents the data collected by Cell 5, which runs in the cell5_metabolomics configuration and is isolated from the default config used by Cells 1-4.

This dataset uses an Extended Schema (49 fields) to include detailed chemical properties.

Statistics

• Version: v10.0.0
• Total Records: 0
• Duplicates Removed: 0
• RDKit Enabled: ⚠️ No
• Last Updated: 2025-11-12

Data Access

Data is split into raw data and train/val/test splits.

1. Load All Raw Data (Recommended)

from datasets import load_dataset
dataset = load_dataset(
    "Milad96/Kluyveromyces-marxianus",
    name="cell5_metabolomics",
    data_dir="cell5_data",
    split="train" 
)
# (dataset contains 0 records)

2. Load Splits

from datasets import load_dataset
splits = load_dataset(
    "Milad96/Kluyveromyces-marxianus",
    name="cell5_metabolomics",
    data_dir="cell5_splits"
)
# splits['train'], splits['validation'], splits['test']

Data Sources

Collector	Category	Records

Schema

This dataset uses an Extended Schema with 49 fields, including cid, inchikey, canonical_smiles, molecular_weight, etc.