Re: [AMBER] Installing Amber20 with cuda9

From: Schröder, David Christopher <>
Date: Thu, 2 Jul 2020 15:11:36 +0000

Hi Suchetana,
I basically only followed the amber 20 manual on how to install.
Unfortunately I have very little knowledge on this installation topics – so it was maybe kind of luck for me.
I did not change any compiler version etc.

I hope some else can help you here.

Best regards,

Von: Suchetana Gupta <>
Gesendet: Donnerstag, 2. Juli 2020 16:53
An: Schröder, David Christopher <>
Betreff: Fwd: [AMBER] Installing Amber20 with cuda9

Just saw your email on Amber forum. We are trying to install amber 20 on our machine running on cuda 10. We have successfully installed the serial version but have not been able to do the cuda version. We are getting the error of incompatible gnu. Our gnu version is 7.5 while amber says it expects 6 or less.
Can you please let us know how you did this?
Suchetana Gupta
IACS, Kolkata
On Thu, 2 Jul 2020, 19:28 Schröder, David Christopher, <<>> wrote:
Dear all,
I successfully installed amber20 serial, MPI and cuda on a VM at a compute cloud with Ubuntu 18.04 as os and cuda 10.2.
However, when I wanted to install vmd 1.9.3 I faced problems - most probably caused by cuda10.

Is it advisable to use cuda 9 with amber20 to overcome this problem?

Best regards,
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Received on Thu Jul 02 2020 - 08:30:02 PDT
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