Re: [AMBER] No PDB space group specified

From: David A Case via AMBER <>
Date: Wed, 20 Jul 2022 10:34:50 -0400

On Tue, Jul 19, 2022, Saranya vasudevan via AMBER wrote:

>Yeah i need the perfect pdb structure with space groups included.

Check the "sg" (spacegroup) option, section in the 2022 Reference
Manual. This allows you to specify the space group in PDB output. (Note
that you need to know what it is -- probably "P 1" for most Amber

...hope this helps...dac

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Received on Thu Aug 04 2022 - 13:35:07 PDT
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