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菊子0909

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[求助] Amber 跑动力学,运行7分钟左右就停止

最近用Amber跑动力学,不加配体的蛋白可以很顺利的跑起来,加了配体之后,总是跑几分钟就停止了
> check UNK
Checking 'UNK'....
Checking parameters for unit 'UNK'.
Checking for bond parameters.
Checking for angle parameters.
Unit is OK.
Checking parameters for unit 'mol'.
Checking for bond parameters.
Checking for angle parameters.
check:  Warnings: 80
Unit is OK.
配体和蛋白处理后都check了,都是Unit is OK
有哪位大神知道问题出在哪了吗?
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