Hi Matthias,

so I spend a few hours to upgrade most (not all) tools to conda. This
was overdue ...

I also put togehter a Docker container:

https://github.com/bgruening/docker-galaxy-chemicaltoolbox

You can start it with:

docker run -i -t -p 8080:80 quay.io/bgruening/galaxy-chemicaltoolbox

Tools included in this container should work everywhere. I found 1 small
bug already and will fix this in the next week, but it should work most
of the times :)

Which tools had the blat dependency? As long as you deal with package_*
repositories you are not using conda packages and then you need to have
these cmake, gcc dependencies isntalled.

Cheers,
Bjoern


Am 19.05.2017 um 13:45 schrieb Matthias Bernt:
> Hi Bjoern,
> 
> I thought I'm using conda .. :). I'm using the ansible
> galaxy-tools-playbook to install tools. I tried before if ansible
> installation and installation via the web interface give the same
> results -- and I recalled that the results were identical. But I was
> wrong -- sorry for the inconvenience.
> 
> Now, when installing via ansible I'm getting identical (compared to
> installation via the web interface) results for blat I choose the
> following options in the tool_list.yaml file.
>   install_tool_dependencies: False
>   install_repository_dependencies: True
>   install_resolver_dependencies: True
> 
> But I still have not understood the dependencies (and dependency
> problems) shown in the web interface... Maybe you could explain this to me?
> 
> In the logs there is first a complaint about missing
>   - blat 35x1*
> then the following packages are installed:
>     blat:   35-1     bioconda
>     libpng: 1.6.27-0
>     zlib:   1.2.8-3
> 
> The admin interface puzzles me: For the blat package:
> - "Dependency Resolver Details" lists blat 35x1 as resolved but not the
> exact version. This seems to be fine.
> - Installed repository dependencies lists package_blat_35x1 as installed
> but missing dependencies. This is odd? Why is this installed at all?
> 
> For the package_blat_35x1
> - Installed repository dependencies lists package_libpng_1_6_7
> - Missing tool dependencies lists blat and libpng. The circular
> dependency to blat is strange, isn't it?
> 
> Thanks again for the support.
> 
> Cheers,
> Matthias
> 
> On 18.05.2017 17:09, Björn Grüning wrote:
>> Hi Matthias,
>>
>> is there any chance you can upgrade your Galaxy and enable conda
>> packages?
>> This would make your life so much easier :)
>>
>> Cheers,
>> Bjoern
>>
>> Am 18.05.2017 um 16:28 schrieb Matthias Bernt:
>>> Hi Bjoern,
>>>
>>> thanks for the explanation. This helped for the openbabel package. Still
>>> there are some packages where I have problems. I guess this is because
>>> on our system the libraries are mostly at non-default locations.
>>>
>>> Currently I have problems to install BLAT. It complains about a missing
>>> zlib. Zlib is installed and the path to the includes is in CPPFLAGS. Is
>>> there any variable that would make it known to the installation process?
>>>
>>> gcc -O -g  -Wall -Wformat -Wimplicit -Wreturn-type -Wuninitialized
>>> -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOU
>>> RCE -D_GNU_SOURCE -DMACHTYPE_x86_64 -DCOLOR32   -Wall -Wformat
>>> -Wimplicit -Wreturn-type -Wuninitialized -I../inc -I../../inc
>>> -I../../../inc -I../../../../inc -I../../../../../inc
>>> -I/gpfs1/data/galaxy_server/gala
>>> xy-dev/database/dependencies/libpng/1.6.7/devteam/package_libpng_1_6_7/3de32cd300a9/include
>>>
>>>   -o zlibFace.o -c zlibFace.c
>>> make: Leaving directory
>>> `/gpfs1/data/galaxy_server/galaxy-dev/database/tmp/tmp-toolshed-mtd4Jyr2N/blat/src
>>>
>>>
>>> /lib'
>>> zlibFace.c:4:18: error: zlib.h: No such file or directory
>>>
>>> An additional question for understanding: There are packages for zlib
>>> and cmake (as example). Why are these not used? Is this because there is
>>> still transition to conda -- which will just need time? But from an
>>> earlier post I thought I understood that package_* is the old non-conda
>>> way.
>>> Or is the intended future state that central packages mentioned in
>>> https://galaxyproject.org/toolshed/package-recipes/
>>> are managed on the system .. and not conda?
>>>
>>> Thanks a lot.
>>>
>>> Cheers,
>>> Matthias
>>>
>>>
>>>
>>> On 17.05.2017 20:08, Björn Grüning wrote:
>>>> Hi Matthias,
>>>>
>>>> if you are installing repositories that still rely on the old
>>>> traditional Galaxy system you need to have a few packages installed
>>>> locally, see this list:
>>>>
>>>> https://galaxyproject.org/toolshed/package-recipes/
>>>>
>>>> However, we have now a new dependency system in Galaxy, that is build
>>>> on-top of conda and most of the Cheminformatic tools have been
>>>> ported to
>>>> Conda already. Which version of Galaxy are you running?
>>>>
>>>> But maybe I have also not pushed the latest changes to the toolshed
>>>> which I have been working on github :(
>>>>
>>>> Ciao,
>>>> Bjoern
>>>>
>>>>
>>>>
>>>> Am 17.05.2017 um 17:04 schrieb Matthias Bernt:
>>>>> Dear galaxy-dev list,
>>>>>
>>>>> I have problems to install package_openbabel. The problem seems to be
>>>>> that cmake is not found during installation.
>>>>>
>>>>> The documentation also states that: "Compiling OpenBabel requires g++
>>>>> and CMake 2.4+"
>>>>>
>>>>> My question is: Does this refer to cmake installed on the system or in
>>>>> galaxy (since there is also package_cmake_3_2_3)?
>>>>>
>>>>> Thanks a lot.
>>>>>
>>>>> Cheers,
>>>>> Matthias
>>>>>
>>>>>
>>>>>
>>>>> ___________________________________________________________
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>>>>>
>>>
> 
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