| Question,Answer,Domain,Difficulty,Type,Task,Reference,Explanation | |
| "*CC1CCC(*)C1, 0.892956655",42.35931484,Materials,Hard,Advanced Reasoning,poylmer-tg-prediction,https://www.kaggle.com/competitions/neurips-open-polymer-prediction-2025/data?select=train.csv, | |
| "*/C=C/c1ccc(*)cc1, 1.006135387",43.3930774,Materials,Hard,Advanced Reasoning,poylmer-tg-prediction,https://www.kaggle.com/competitions/neurips-open-polymer-prediction-2025/data?select=train.csv, | |
| "*CCCCCCCCCOC(=O)CCCCCCCC(=O)O*, 0.941870155",3.667443154,Materials,Hard,Advanced Reasoning,poylmer-tg-prediction,https://www.kaggle.com/competitions/neurips-open-polymer-prediction-2025/data?select=train.csv, | |
| "*c1ccc2c(c1)SC1=Nc3cc(-c4ccc5c(c4)N=C4Sc6cc(*)ccc6N=C4N5)ccc3NC1=N2, 1.086875784",418.69,Materials,Hard,Advanced Reasoning,poylmer-tg-prediction,https://www.kaggle.com/competitions/neurips-open-polymer-prediction-2025/data?select=train.csv, | |
| "*C(=O)C(*)(C)C, 0.919975664",105.8292511,Materials,Hard,Advanced Reasoning,poylmer-tg-prediction,https://www.kaggle.com/competitions/neurips-open-polymer-prediction-2025/data?select=train.csv, | |
| "*CCCCCCN(C)C(=O)CCCCCCCCCCCCCCCCC(=O)N(*)C, 0.898624404",49.34222836,Materials,Hard,Advanced Reasoning,poylmer-tg-prediction,https://www.kaggle.com/competitions/neurips-open-polymer-prediction-2025/data?select=train.csv, | |
| "*CC(*)(C)C(=O)Oc1ccc(C)cc1, 0.951958497",126.1154692,Materials,Hard,Advanced Reasoning,poylmer-tg-prediction,https://www.kaggle.com/competitions/neurips-open-polymer-prediction-2025/data?select=train.csv, | |
| "*CCCCCCCCCCNC(=O)C(CCCCCCCCCCCC)C(=O)N*, 0.888311048",-0.868265132,Materials,Hard,Advanced Reasoning,poylmer-tg-prediction,https://www.kaggle.com/competitions/neurips-open-polymer-prediction-2025/data?select=train.csv, | |
| "*Sc1ccc(*)cc1, 1.231097312",64.586946,Materials,Hard,Advanced Reasoning,poylmer-tg-prediction,https://www.kaggle.com/competitions/neurips-open-polymer-prediction-2025/data?select=train.csv, | |
| "*C1C(=O)N(c2ccccc2)C(=O)C1*, 1.03911953",197.1821336,Materials,Hard,Advanced Reasoning,poylmer-tg-prediction,https://www.kaggle.com/competitions/neurips-open-polymer-prediction-2025/data?select=train.csv, | |
| "*/C=C/*, 0.775000418",59.5588378,Materials,Hard,Advanced Reasoning,poylmer-tg-prediction,https://www.kaggle.com/competitions/neurips-open-polymer-prediction-2025/data?select=train.csv, | |
| "*C*, 0.811251102",-2.526682925,Materials,Hard,Advanced Reasoning,poylmer-tg-prediction,https://www.kaggle.com/competitions/neurips-open-polymer-prediction-2025/data?select=train.csv, | |
| "*CCCCCNC(=O)O*, 1.071824251",-13.55087665,Materials,Hard,Advanced Reasoning,poylmer-tg-prediction,https://www.kaggle.com/competitions/neurips-open-polymer-prediction-2025/data?select=train.csv, | |
| "*c1cc(O)c(O)cc1*, 0.986360805",158.9171015,Materials,Hard,Advanced Reasoning,poylmer-tg-prediction,https://www.kaggle.com/competitions/neurips-open-polymer-prediction-2025/data?select=train.csv, | |
| "*C1CCC1*, 0.823406686",69.57488221,Materials,Hard,Advanced Reasoning,poylmer-tg-prediction,https://www.kaggle.com/competitions/neurips-open-polymer-prediction-2025/data?select=train.csv, | |
| "*CCCCCCCCCCNC(=O)CCCCCCCCC(=O)NCCCCCCCCCCNC(=O)C(=O)N*, 0.955200662",82.2677155,Materials,Hard,Advanced Reasoning,poylmer-tg-prediction,https://www.kaggle.com/competitions/neurips-open-polymer-prediction-2025/data?select=train.csv, | |
| "*CC(CC(*)(C#N)C(=O)OC)c1ccccc1, 0.987197772",127.0156605,Materials,Hard,Advanced Reasoning,poylmer-tg-prediction,https://www.kaggle.com/competitions/neurips-open-polymer-prediction-2025/data?select=train.csv, | |
| "*CCc1c(Cl)c(Cl)c(*)c(Cl)c1Cl, 1.40293716",56.1987128,Materials,Hard,Advanced Reasoning,poylmer-tg-prediction,https://www.kaggle.com/competitions/neurips-open-polymer-prediction-2025/data?select=train.csv, | |
| "*CC(*)C(=O)OC(C)CC(C)C, 0.905312834",11.47675289,Materials,Hard,Advanced Reasoning,poylmer-tg-prediction,https://www.kaggle.com/competitions/neurips-open-polymer-prediction-2025/data?select=train.csv, | |
| "*CC(*)C(=O)NCCCC, 0.938352718",-84.72234668,Materials,Hard,Advanced Reasoning,poylmer-tg-prediction,https://www.kaggle.com/competitions/neurips-open-polymer-prediction-2025/data?select=train.csv, | |
| "*CCCCCCCCCNC(=O)CCCCCCCC(=O)N*, 0.944002177",9.904824538,Materials,Hard,Advanced Reasoning,poylmer-tg-prediction,https://www.kaggle.com/competitions/neurips-open-polymer-prediction-2025/data?select=train.csv, | |
| "*c1ccc(-c2ccc(C(*)(C)C)cc2)cc1, 0.952850626",210.9469969,Materials,Hard,Advanced Reasoning,poylmer-tg-prediction,https://www.kaggle.com/competitions/neurips-open-polymer-prediction-2025/data?select=train.csv, | |
| "*CC(*)C(=O)NCCCCCCCCCCCC, 0.870895681",21.73577755,Materials,Hard,Advanced Reasoning,poylmer-tg-prediction,https://www.kaggle.com/competitions/neurips-open-polymer-prediction-2025/data?select=train.csv, | |
| "*c1ccc(C2C(C(=O)OCC)C(*)C2C(=O)OCC)cc1, 1.011107838",164.3224631,Materials,Hard,Advanced Reasoning,poylmer-tg-prediction,https://www.kaggle.com/competitions/neurips-open-polymer-prediction-2025/data?select=train.csv, |