Re: [AMBER-Developers] CUDA build fails for PBSA

From: Ray Luo <rluo.uci.edu>
Date: Fri, 10 Mar 2017 10:34:06 -0800

Gerald,

After I "git add" these files by force, looks like they are in. Could
you check whether you can see these files?

I'm compiling a "git clean -xfd"-ed version.

Ray
--
Ray Luo, Ph.D.
Professor of Structural Biology/Biochemistry/Biophysics,
Chemical Physics, Biomedical Engineering, and Chemical Engineering
Department of Molecular Biology and Biochemistry
University of California, Irvine, CA 92697-3900
On Fri, Mar 10, 2017 at 8:30 AM, Gerald Monard
<Gerald.Monard.univ-lorraine.fr> wrote:
> Hello,
>
> When I compare the "original" (=downloaded) version of
> cusplibrary-0.5.1, I can see the following files missing in the amber
> git tree:
> ./build
> ./build/build-env.py
> ./build/g++.py
> ./build/nvcc.py
> ./cusp
> ./cusp/detail
> ./cusp/detail/config.h
>
> All the best,
>
> Gerald.
>
> On 03/10/2017 02:39 PM, Jason Swails wrote:
>> On Fri, Mar 10, 2017 at 8:12 AM, Daniel Roe <daniel.r.roe.gmail.com> wrote:
>>
>>> As of commit 372e01050807ea56cfe36e8164a4f8b4d59b9d1b, still broken. Same
>>> error.
>>>
>>> ```
>>> /usr/local/cuda-7.5/bin/nvcc -gencode arch=compute_20,code=sm_20
>>> -gencode arch=compute_30,code=sm_30 -gencode
>>> arch=compute_50,code=sm_50 -gencode arch=compute_52,code=sm_52
>>> -gencode arch=compute_53,code=sm_53 -use_fast_math -O3  -ccbin g++
>>> -I../cusplibrary-0.5.1 -o cuda_cg_wrapper.o -c cuda_cg_wrapper.cu
>>> -DCUSP -DPCG -DJacobi -DDIA
>>> In file included from cuda_cg_wrapper.cu:832:0:
>>> ../cusplibrary-0.5.1/cusp/csr_matrix.h:23:32: fatal error:
>>> cusp/detail/config.h: No such file or directory
>>>  #include <cusp/detail/config.h>
>>> ```
>>
>>
>>> File is indeed missing:
>>>
>>> ```
>>> $ cd $AMBERHOME/AmberTools/src/pbsa
>>> $ ls ../cusplibrary-0.5.1/cusp/detail/config.h
>>> ls: cannot access ../cusplibrary-0.5.1/cusp/detail/config.h: No such
>>> file or directory
>>> ```
>>
>>
>>> There is no config.h anywhere in the cusp directory. Have you tested
>>> by pulling a fresh copy into a new directory and then attempting to
>>> configure/install? Am I the only one seeing this?
>>>
>>
>> config.h is in .gitignore (since we don't want to track *our* config.h).
>> This is preventing Ray from adding it and "git status" from finding it.
>>
>> I've fixed this so it should ignore *only* the config.h files that our
>> configure script generates..
>>
>> .Ray, try adding it again.  And after you do, please try a fresh clone and
>> build (which would have caught this missing file) and make sure that works
>> first.
>>
>> All the best,
>> Jason
>>
>
> --
> ____________________________________________________________________________
>
>   Prof. Gerald MONARD
>   Directeur du mésocentre EXPLOR
>   Université de Lorraine
>   Boulevard des Aiguillettes B.P. 70239
>   F-54506 Vandoeuvre-les-Nancy, FRANCE
>
>   e-mail : Gerald.Monard.univ-lorraine.fr
>   phone  : +33 (0)372.745.279
>   web    : http://www.monard.info
>
> ____________________________________________________________________________
>
>
> _______________________________________________
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Received on Fri Mar 10 2017 - 11:00:02 PST
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