"""Illustrative study/content-grouped split, not an official benchmark protocol.""" from __future__ import annotations import argparse import hashlib from pathlib import Path import pandas as pd from hesrt_io import RELEASE_TAG, load_catalog def assign_groups(frame: pd.DataFrame, seed: str) -> pd.DataFrame: """Keep each GSE and any exact image/expression duplicates in one component.""" frame = frame.reset_index(drop=True) parent = list(range(len(frame))) def root(i: int) -> int: while parent[i] != i: parent[i] = parent[parent[i]] i = parent[i] return i for column in ["gse_id", "image_sha256", "expression_sha256"]: first: dict[str, int] = {} for i, value in enumerate(frame[column]): if pd.isna(value) or not str(value).strip(): continue value = str(value) if value in first: parent[root(i)] = root(first[value]) else: first[value] = i labels: dict[int, str] = {} for i, gsm in enumerate(frame.gsm_id): r = root(i) labels[r] = min(labels.get(r, str(gsm)), str(gsm)) result = frame[["gse_id", "gsm_id"]].copy() result["leakage_group"] = [labels[root(i)] for i in range(len(frame))] def split(group: str) -> str: fraction = int(hashlib.sha256((seed + ":" + group).encode()).hexdigest()[:16], 16) / 2**64 return "train" if fraction < 0.8 else "validation" if fraction < 0.9 else "test" result["split"] = result.leakage_group.map(split) return result def main() -> None: parser = argparse.ArgumentParser(description=__doc__) parser.add_argument("--revision", default=RELEASE_TAG) parser.add_argument("--seed", default="hesrt-example-0") parser.add_argument("--output", type=Path, default=Path("study_split.csv")) args = parser.parse_args() frame, revision = load_catalog(args.revision) result = assign_groups(frame, args.seed) result["revision"] = revision args.output.parent.mkdir(parents=True, exist_ok=True) result.to_csv(args.output, index=False) print(result.groupby("split").agg(samples=("gsm_id", "size"), studies=("gse_id", "nunique"))) print("Approximate 80/10/10 group allocation; not stratified and not donor-disjoint certification.") print("Resolve shared donors, near-duplicates, cohort overlap and task eligibility separately.") if __name__ == "__main__": main()