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Acellera / htmd

HTMD: Programming Environment for Molecular Discovery
https://software.acellera.com/docs/latest/htmd/index.html
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HTMD not working with GTX1650 #1067

Closed khairbux2023 closed 10 months ago

khairbux2023 commented 11 months ago

Actually I am using the htmd package with just a single GPU GTX 1650 but its not working and demands license

Can you please help me resolving this issue as mentioned below

ACEMD version 3.5.0

#

Copyright (C) 2017-2021 Acellera (www.acellera.com)

#

When publishing, please cite:

ACEMD: Accelerating Biomolecular Dynamics in the Microsecond Time Scale

M. J. Harvey, G. Giupponi and G. De Fabritiis,

J Chem. Theory. Comput. 2009 5(6), pp1632-1639

DOI: 10.1021/ct9000685

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Arguments:

input: input_equil

platform:

device:

ncpus:

precision: mixed

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Licence:

Check floating licence:

ACELLERA_LICENCE_SERVER -- not defined

ACELLERA_LICENSE_SERVER -- not defined

Check node-locked licence:

ACELLERA_LICENCE_FILE -- not defined

ACELLERA_LICENSE_FILE -- not defined

/opt/acellera/licence.dat -- DENIED (Unable to locate target file)

/opt/acellera/license.dat -- DENIED (Unable to locate target file)

/home/ali/.acellera/licence.dat -- DENIED (Unable to locate target file)

/home/ali/.acellera/license.dat -- DENIED (Unable to locate target file)

#

This version of ACEMD has expired!

You should update to the latest version.

If you want to continue using this version, you need a licence.

giadefa commented 11 months ago

You should update to the latest version.

On Sat, 5 Aug 2023 at 14:02, Ali2030 @.***> wrote:

Actually I am using the htmd package with just a single GPU GTX 1650 but its not working and demands license

Can you please help me resolving this issue as mentioned below ACEMD version 3.5.0 Copyright (C) 2017-2021 Acellera (www.acellera.com) When publishing, please cite: ACEMD: Accelerating Biomolecular Dynamics in the Microsecond Time Scale M. J. Harvey, G. Giupponi and G. De Fabritiis, J Chem. Theory. Comput. 2009 5(6), pp1632-1639 DOI: 10.1021/ct9000685 Arguments: input: input_equil platform: device: ncpus: precision: mixed Licence: Check floating licence: ACELLERA_LICENCE_SERVER -- not defined ACELLERA_LICENSE_SERVER -- not defined Check node-locked licence: ACELLERA_LICENCE_FILE -- not defined ACELLERA_LICENSE_FILE -- not defined /opt/acellera/licence.dat -- DENIED (Unable to locate target file) /opt/acellera/license.dat -- DENIED (Unable to locate target file) /home/ali/.acellera/licence.dat -- DENIED (Unable to locate target file) /home/ali/.acellera/license.dat -- DENIED (Unable to locate target file) This version of ACEMD has expired! You should update to the latest version. If you want to continue using this version, you need a licence.

— Reply to this email directly, view it on GitHub https://github.com/Acellera/htmd/issues/1067, or unsubscribe https://github.com/notifications/unsubscribe-auth/AB3KUOSZQNED5HST7X6E7LTXTYY6VANCNFSM6AAAAAA3FFMJ6M . You are receiving this because you are subscribed to this thread.Message ID: @.***>

khairbux2023 commented 11 months ago

@giadefa thank you for the comment. What should I actually update my GPU or htmd version?

giadefa commented 11 months ago

reinstall ACEMD/HTMD so that the new version is loaded

On Mon, 7 Aug 2023 at 09:31, Ali2030 @.***> wrote:

@giadefa https://github.com/giadefa thank you for the comment. What should I actually update my GPU or htmd version?

— Reply to this email directly, view it on GitHub https://github.com/Acellera/htmd/issues/1067#issuecomment-1667339473, or unsubscribe https://github.com/notifications/unsubscribe-auth/AB3KUOSBIBWQFV2MDS3ZTJTXUCKW3ANCNFSM6AAAAAA3FFMJ6M . You are receiving this because you were mentioned.Message ID: @.***>