安装开源的PyMOL (open-source)
PyMOL是一款用于蛋白质结构可视化,可进行蛋白互作分析、蛋白与分子对接、及药物设计等。以下是开源PyMOL软件的安装流程。如果对你有帮助的话麻烦点个关注加收藏啊,谢谢!!!
1. PyMOL的使用依赖的Python环境
安装PyMOL之前必须安装python,另外需要注意PyMOL的开源版本必须同python保持抑制,否则无法正常使用PyMOL。我是用的是python 3.12 Download Python | Python.orgThe official home of the Python Programming Languagehttps://www.python.org/downloads/记住python下载安装的路径,我这里是C:\Users\cxf\AppData
2 .numpy、pmw、pyqt5 文件下载
按住Window+R输入cmd
python -m pip install numpy
python -m pip install pmw
python -m pip install pyqt5
输入上述代码,下载三个文件
3 从以下链接下载预编译的开源 PyMOL wheel 文件,兼容 Python 3.12 和 Windows 64 位:
https://github.com/cnpem/PyMOL4Win/releases/latest/download/pymol_launcher-2.6-cp312-cp312-win_amd64.whlhttps://github.com/cnpem/PyMOL4Win/releases/latest/download/pymol_launcher-2.6-cp312-cp312-win_amd64.whlhttps://github.com/cnpem/PyMOL4Win/releases/latest/download/pymol-2.6.0a0-cp312-cp312-win_amd64.whl
https://github.com/cnpem/PyMOL4Win/releases/latest/download/pymol-2.6.0a0-cp312-cp312-win_amd64.whlhttps://github.com/cnpem/PyMOL4Win/releases/latest/download/pymol_launcher-2.6-cp312-cp312-win_amd64.whl
https://github.com/cnpem/PyMOL4Win/releases/latest/download/pymol_launcher-2.6-cp312-cp312-win_amd64.whl
4. 在 cmd 窗口(不是 PowerShell!),切换到下载目录(C:\Users\cxf\AppData):
cd /d C:\Users\cxf\AppData
5. 下载匹配的文件 pymol_launcher-2.6-cp312-cp312-win_amd64.whl
:
python -m pip install --no-index --find-links="%CD%" pymol_launcher-2.6-cp312-cp312-win_amd64.whl
6. 最后下载 pymol-2.6.0a0-cp312-cp312-win_amd64.whl
:
python -m pip install --upgrade --no-deps pymol-2.6.0a0-cp312-cp312-win_amd64.whl
7. 在CMD (not PowerShell!)运行:
where.exe pymol
pymol
8. PyMOL v2.6 安装好,打开PyMOL.
where.exe pymol