sGDML:sGDML-对称梯度域机器学习模型的参考实现

上传者: 42125867 | 上传时间: 2022-05-25 15:19:46 | 文件大小: 89KB | 文件类型: ZIP
对称梯度域机器学习(sGDML) 有关更多详细信息,请访问: : 可以在这里找到文档: : 要求: Python 3.7以上 NumPy(> = 1.19) 科学(> = 1.1) 可选的: PyTorch(用于GPU加速) ASE(> = 3.16.2)(运行原子模拟) 入门 稳定释放 大多数系统pip预先安装了针对Python pip的默认软件包管理器。 只需调用以下sgdml即可安装sgdml : $ pip install sgdml sgdml命令行界面和相应的Python API现在可以在系统上的任何位置使用。 开发版 (1)克隆存储库 $ git clone https://github.com/stefanch/sGDML.git $ cd sGDML ...或更新您现有的本地副本 $ git pull origin master (2)安装 $ pi

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