Re: Build NAMD with CUDA for unix workstation (centos 7)

From: Haohao Fu (fhh2626_at_gmail.com)
Date: Wed Sep 20 2017 - 03:25:16 CDT

something like:

CHARM = /xxxxxxx/NAMD_Git-2017-05-27_Source/charm-6.8.0-beta2

Haohao

2017-09-20 16:04 GMT+08:00 Daipayan Sarkar <sdaipayan_at_gmail.com>:

> Thanks for the steps.
>
> revise "CHARM = xxxxxxxxxxx" in Make.config to a absolute pathway
>
> Do I add the path similar to the cuda-prefix?
>
>
> Regards,
>
> Daipayan
>
>
> On Wed, Sep 20, 2017 at 2:22 AM, Haohao Fu <fhh2626_at_gmail.com> wrote:
>
>> Suppose you already have fftw and tcl folder in the NAMD directory
>>
>> Then you can do:
>> (build charm)
>> tar xvf charm-xxxxx.tar
>> cd charm-xxxxx
>> ./build
>>
>> (build NAMD with CUDA)
>> cd ..
>> ./config Linux-x86_64-g++ --with-cuda --cuda-prefix /xxxxxxxxxxxxxx
>> cd Linux-x86_64-g++
>> revise "CHARM = xxxxxxxxxxx" in Make.config to a absolute pathway
>> make -j
>>
>> Haohao
>>
>> 2017-09-20 14:54 GMT+08:00 Daipayan Sarkar <sdaipayan_at_gmail.com>:
>>
>>> Hi,
>>>
>>> Can someone share the steps to build a NAMD executable with CUDA enabled
>>> for a multicore Unix workstation? The CUDA toolkit, I am using is
>>> 'cuda-repo-rhel7-8-0-local-ga2-8.0.61-1.x86_64.rpm' for centos 7 and
>>> x86_64.
>>>
>>> Thanks,
>>> Daipayan
>>>
>>>
>>
>

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