(3个国二,3种解法)2021年华为杯数学建模D题抗乳腺癌候选药物的优化建模

上传者: m0_56167463 | 上传时间: 2022-04-15 18:12:55 | 文件大小: 24.47MB | 文件类型: ZIP
①随机森林+相关性分析。采用决策树回归、线性回归、梯度提升向量机、改进型贪心调优 ②根据提供的ERα拮抗剂信息(1974个化合物样本,每个样本都有729个分子描述符变量,1个生物活性数据,5个ADMET性质数据),构建化合物生物活性的定量预测模型和ADMET性质的分类预测模型,从而为同时优化ERα拮抗剂的生物活性和ADMET性质提供预测服务。 ③代码很全,横向纵向可对比,并提供模型,3种解法

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