[AMBER] output of radius of gyration

From: Zhuang, Yu <yu.zhuang.tum.de>
Date: Mon, 20 Jan 2014 11:13:00 +0000

Dear Amber users,
I have one question regarding output of radius of gyration from Amber 12. I have finished my simulation and results in two outputs, e.g. file.prmtop and file.mdcrd. however when I want to use 'ptraj' and 'trajin' to export radius of gyration, it always results in to a file with empty content. I used the command like this: radgyr out protein.dat mass

Do anyone meet same problem before? how can I solve it?

Thanks in advance.

Cheers, Yu Zhuang

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Received on Mon Jan 20 2014 - 03:30:02 PST
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