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์ก์ ๋ฐ๋ฅ์ ํํฉ๋ฌผ ๊ตฐ์ง ๊ธฐ์ค์ผ๋ก ์ฌ๊ณ์ฐ โ ์์ด ์๋๋ผ ํํฉ๋ฌผ์ด ํ๋ณธ ๋จ์ (์ค์ 0.46๋ฐฐ)
73bc51c verified | { | |
| "board": "CYP2D6", | |
| "target": "CHEMBL289", | |
| "type": "IC50", | |
| "cut": 2022, | |
| "threshold": 5.0, | |
| "n_train": 2676, | |
| "n_test": 268, | |
| "positive_rate": 0.44029850746268656, | |
| "noise_floor": { | |
| "pairs": 2958, | |
| "compounds": 100, | |
| "median": 0.5419716871893607, | |
| "mean": 0.7433935990968057, | |
| "p75": 1.0469965626762239, | |
| "p90": 1.7739347659824798, | |
| "sd_single": 0.21591270911680713, | |
| "sd_ci95": [ | |
| 0.118, | |
| 0.3365 | |
| ], | |
| "sd_single_pairwise_deprecated": 0.65903687863192, | |
| "n_effective": 100 | |
| }, | |
| "baselines": { | |
| "์์ ์์ธก": { | |
| "auroc": 0.5, | |
| "prauc": 0.44029850746268656, | |
| "mae": 0.596600795371179 | |
| }, | |
| "์ต๊ทผ์ ์ด์": { | |
| "auroc": 0.570225988700565, | |
| "prauc": 0.47987148312398575, | |
| "mae": 0.7231413517206466 | |
| }, | |
| "Morgan+LightGBM": { | |
| "auroc": 0.5662994350282486, | |
| "prauc": 0.5129934490737377, | |
| "mae": 0.666372615929406 | |
| } | |
| }, | |
| "near_threshold": 200, | |
| "split_grade": "T", | |
| "split_grade_note": "์ต์ด ๋ณด๊ณ ์ฐ๋ ๊ธฐ์ค ์๊ฐ ๋ถํ ", | |
| "answer_grade": "P1", | |
| "answer_grade_note": "์ ๋ต์ด ChEMBL ์ ๊ณต๊ฐ๋์ด ์๋ค. ์กฐํ ๋ฐฉ์ด๋ 8์กฐ๊ฐ ๋งก๋๋ค", | |
| "source": "ChEMBL_37", | |
| "built": "2026-08-22" | |
| } |