How to Call NAMD Molecular dynamics software from *.bat file on windows?

10 October 2016 0 8K Report

Hi All,

1-How Can I call "NAMD" (Molecular Dynamics software) from *.bat file on windows.

Usually, I use cmd.exe to run NAMD by the following command: namd2 +p12 input.conf > output.log.

I need now to call NAMD from *.bat file considering there are input (input.conf) and output (output.log) files.

2- How Can I call multiple "NAMD" tasks form *.bat file, I need to do multiple parallel minimization processes for different structures in the same folder.

Thanks All,

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