Re: [AMBER] Problems of sander.quick.cuda

From: aa <xmgign.126.com>
Date: Fri, 25 Feb 2022 15:17:57 +0800 (CST)

Hi Vin¨ªcius,
The last line of quick.out is:


|109 -1322.063008948 -.250813E+00 0.590 9 0.04 0.55 0.03 0.1709E+00 0.8693E-02 0.1333E+01
|110 -1322.127485998 0.644771E-01 0.591 10 0.05 0.55 0.03 0.2102E+00 0.7043E-02 0.1117E+01


Best,
Qiao



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Received on Thu Feb 24 2022 - 23:30:02 PST
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