├── ADMET.xlsx ├── ADMET_predict.xlsx ├── ERα_activity.xlsx ├── ERα_activity_predict.xlsx ├── MathematicalModelingCompetition.py ├── Molecular_Descriptor.xlsx ├── code.ipynb ├── concat.csv ├── features_select.xlsx ├── 分子描述符含义解释.xlsx └── 抗胰腺癌候选药物的优化建模.docx /ADMET.xlsx: -------------------------------------------------------------------------------- https://raw.githubusercontent.com/LHugo/MathematicalModelingCompetition/HEAD/ADMET.xlsx -------------------------------------------------------------------------------- /ADMET_predict.xlsx: -------------------------------------------------------------------------------- https://raw.githubusercontent.com/LHugo/MathematicalModelingCompetition/HEAD/ADMET_predict.xlsx -------------------------------------------------------------------------------- /ERα_activity.xlsx: -------------------------------------------------------------------------------- https://raw.githubusercontent.com/LHugo/MathematicalModelingCompetition/HEAD/ERα_activity.xlsx -------------------------------------------------------------------------------- /ERα_activity_predict.xlsx: -------------------------------------------------------------------------------- https://raw.githubusercontent.com/LHugo/MathematicalModelingCompetition/HEAD/ERα_activity_predict.xlsx -------------------------------------------------------------------------------- /MathematicalModelingCompetition.py: -------------------------------------------------------------------------------- https://raw.githubusercontent.com/LHugo/MathematicalModelingCompetition/HEAD/MathematicalModelingCompetition.py -------------------------------------------------------------------------------- /Molecular_Descriptor.xlsx: -------------------------------------------------------------------------------- https://raw.githubusercontent.com/LHugo/MathematicalModelingCompetition/HEAD/Molecular_Descriptor.xlsx -------------------------------------------------------------------------------- /code.ipynb: -------------------------------------------------------------------------------- https://raw.githubusercontent.com/LHugo/MathematicalModelingCompetition/HEAD/code.ipynb -------------------------------------------------------------------------------- /concat.csv: -------------------------------------------------------------------------------- https://raw.githubusercontent.com/LHugo/MathematicalModelingCompetition/HEAD/concat.csv -------------------------------------------------------------------------------- /features_select.xlsx: -------------------------------------------------------------------------------- https://raw.githubusercontent.com/LHugo/MathematicalModelingCompetition/HEAD/features_select.xlsx -------------------------------------------------------------------------------- /分子描述符含义解释.xlsx: -------------------------------------------------------------------------------- https://raw.githubusercontent.com/LHugo/MathematicalModelingCompetition/HEAD/分子描述符含义解释.xlsx -------------------------------------------------------------------------------- /抗胰腺癌候选药物的优化建模.docx: -------------------------------------------------------------------------------- https://raw.githubusercontent.com/LHugo/MathematicalModelingCompetition/HEAD/抗胰腺癌候选药物的优化建模.docx --------------------------------------------------------------------------------