Re: [AMBER] Does pmemd.cuda support QM/MM

From: Elvis Martis <>
Date: Fri, 8 Dec 2017 10:27:12 +0000

To the best of my knowledge, pmemd does not support QM/MM calculations and hence pmemd.cuda will also not support.

Best Regards
Elvis Martis
Mumbai, INDIA.

From: MinYuan <>
Sent: 08 December 2017 13:33
Subject: [AMBER] Does pmemd.cuda support QM/MM


In Amber16 manual, it says that sander supports QM/MM calculations.
Does pmemd.cuda support QM/MM?

Looking forward to hear your reply.

Best wishes
Yuan Min
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Received on Fri Dec 08 2017 - 02:30:03 PST
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