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/software/cmake/3.10.0/bin/cmake -H/home/sbinkas/software/votca
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/software/gcc/5.4.0/bin/g++ -I/home/sbinkas/software/votca/tools/include
-I/home/sbinkas/software/votca/build/tools/include -isystem
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In file included from
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from
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from
/home/sbinkas/software/votca/tools/src/tools/votca_property.cc:22:
/home/sbinkas/software/include/eigen3/unsupported/Eigen/FFT:75:21: fatal
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make: *** [all] Error 2
On Sat, Apr 25, 2020 at 1:59 PM Christoph Junghans <[email protected]>
wrote:
>
>
> On Sat, Apr 25, 2020 at 11:45 Salman Bin Kashif <[email protected]>
> wrote:
>
>> I have attached the printed output from cmake command herewith
>>
> thanks, please do me a favor and also attach the output of “make
> VERBOSE=1”.
>
>>
>> On Sat, Apr 25, 2020 at 1:41 PM Christoph Junghans <[email protected]>
>> wrote:
>>
>>>
>>>
>>> On Sat, Apr 25, 2020 at 11:25 Salman Bin Kashif <[email protected]>
>>> wrote:
>>>
>>>> Thank you. That works too. Next error was encountered in make -j5
>>>> command.
>>>>
>>>
>>>> /home/sbinkas/software/include/eigen3/unsupported/Eigen/FFT:75:21:
>>>> fatal error: fftw3.h: No such file or directory
>>>>
>>> it seems the fftw3 dev package is missing!
>>>
>>> Can you post the output of your CMake execution, what fftw3 found?
>>>
>>> Christoph
>>>
>>>>
>>>>
>>>> I didn't find fftw.h in the entire eigen folder though. I am not sure
>>>> which path should I provide then.
>>>>
>>>> On Sat, Apr 25, 2020 at 1:03 PM Christoph Junghans <[email protected]>
>>>> wrote:
>>>>
>>>>> On Sat, Apr 25, 2020 at 10:52 AM Salman Bin Kashif <
>>>>> [email protected]> wrote:
>>>>> >
>>>>> > Thank you. This suggestion works. The cmake command did not throw
>>>>> any fatal error this time.
>>>>> >
>>>>> > However, I would like to discuss some caveats:
>>>>> >
>>>>> > 1. Would TXT2TAGS not being found be an issue in later steps? Like
>>>>> when running the simulation? It does suggest optional. But I assume it may
>>>>> be used for generating xml files during run.
>>>>> txt2tags is only used to build the manpage (documentation), so no
>>>>> issue here.
>>>>> >
>>>>> > 2. Warning with run time library:
>>>>> >
>>>>> > Cannot generate a safe runtime search path for target votca_tools
>>>>> because
>>>>> > files in some directories may conflict with libraries in implicit
>>>>> > directories:
>>>>> >
>>>>> > runtime library [libexpat.so.1] in /usr/lib64 may be hidden by
>>>>> files in:
>>>>> > /home/sbinkas/software/lib
>>>>> This error basically means there are two libexpat in your
>>>>> LD_LIBRARY_PATH.
>>>>> You tell CMake to explicitly use the one from
>>>>> /home/sbinkas/software/lib by add
>>>>> -DCMAKE_PREFIX_PATH=/home/sbinkas/software.
>>>>>
>>>>> Christoph
>>>>> >
>>>>> > I kind of get where is it coming from. This
>>>>> /home/sbinkas/software/lib got added while installing one of the
>>>>> dependencies. I don't remember which one to be exact, but possibly it was
>>>>> from eigen3. So a conflict may have arisen. Should I worry about it?
>>>>> >
>>>>> > Again, I very much appreciate your help.
>>>>> >
>>>>> > -Salman
>>>>> >
>>>>> >
>>>>> > Output:
>>>>> >
>>>>> >
>>>>> > - The following OPTIONAL packages have been found:
>>>>> >
>>>>> > * Git
>>>>> > * FFTW3
>>>>> > * UnixCommands
>>>>> > * PkgConfig
>>>>> > * HDF5
>>>>> > * Doxygen
>>>>> >
>>>>> > -- The following REQUIRED packages have been found:
>>>>> >
>>>>> > * EXPAT
>>>>> > * Threads
>>>>> > * Boost (required version >= 1.53.0)
>>>>> > * Eigen3 (required version >= 3.3.0)
>>>>> > * GROMACS (required version >= 2016)
>>>>> >
>>>>> > -- The following OPTIONAL packages have not been found:
>>>>> >
>>>>> > * MKL
>>>>> > * TXT2TAGS
>>>>> > * CLANG_FORMAT (required version >= 7.0.1)
>>>>> >
>>>>> > -- Configuring done
>>>>> > CMake Warning at tools/src/libtools/CMakeLists.txt:5 (add_library):
>>>>> > Cannot generate a safe runtime search path for target votca_tools
>>>>> because
>>>>> > files in some directories may conflict with libraries in implicit
>>>>> > directories:
>>>>> >
>>>>> > runtime library [libexpat.so.1] in /usr/lib64 may be hidden by
>>>>> files in:
>>>>> > /home/sbinkas/software/lib
>>>>> >
>>>>> > Some of these libraries may not be found correctly.
>>>>> >
>>>>> >
>>>>> > -- Generating done
>>>>> > -- Build files have been written to:
>>>>> /home/sbinkas/software/votca/build
>>>>> >
>>>>> > On Sat, Apr 25, 2020 at 12:31 PM Christoph Junghans <
>>>>> [email protected]> wrote:
>>>>> >>
>>>>> >> On Sat, Apr 25, 2020 at 10:26 AM Salman Bin Kashif <
>>>>> [email protected]> wrote:
>>>>> >> >
>>>>> >> > This is the error associated with libgromacs:
>>>>> >> >
>>>>> >> > gmake[1]: *** No rule to make target
>>>>> `/home/sbinkas/gromacs/lib/libgromacs.so', needed by `cmTC_b3327 '.
>>>>> Stop.
>>>>> >> > 101 gmake[1]: Leaving directory
>>>>> `/home/sbinkas/software/votca/build/CMakeFiles/CMakeTmp'
>>>>> >> > 102 gmake: *** [cmTC_b3327/fast] Error 2
>>>>> >> In the CMake output it says, it is using
>>>>> >> /home/sbinkas/software/gromacs-2018.3/lib64/libgromacs.so, but now
>>>>> it
>>>>> >> is looking for
>>>>> >> `/home/sbinkas/gromacs/lib/libgromacs.so, you might want to help
>>>>> CMake
>>>>> >> by setting
>>>>> -DGROMACS_LIBRARY=/home/sbinkas/software/gromacs-2018.3/lib64/libgromacs.so.
>>>>> >>
>>>>> >> Christoph
>>>>> >> >
>>>>> >> > On Sat, Apr 25, 2020 at 12:12 PM Christoph Junghans <
>>>>> [email protected]> wrote:
>>>>> >> >>
>>>>> >> >> On Sat, Apr 25, 2020 at 8:53 AM Salman Bin Kashif <
>>>>> [email protected]> wrote:
>>>>> >> >> >
>>>>> >> >> > Thanks very much for being patient with me.
>>>>> >> >> >
>>>>> >> >> > I had installed eigen3 easier which incidentally happen to be
>>>>> from the same source you pointed out. Eigen is being read properly I
>>>>> assume.
>>>>> >> >> >
>>>>> >> >> > -- Found Eigen3:
>>>>> /home/sbinkas/software/eigen-eigen-67e894c6cd8f/build_dir
>>>>> >> >> >
>>>>> >> >> > However, there are two more issues:
>>>>> >> >> >
>>>>> >> >> > -- Could NOT find TXT2TAGS (missing: TXT2TAGS_EXECUTABLE)
>>>>> >> >> > txt2tags not found, help cmake to find it by setting
>>>>> TXT2TAGS_EXECUTABLE
>>>>> >> >> >
>>>>> >> >> >
>>>>> >> >> > I have provided the path to executable txt2tags file in
>>>>> /home/software/txt2tags-2.6/txt2tags but it still is not fould. However,
>>>>> the error was not fatal due to it.
>>>>> >> >> Don't worry this one is optional.
>>>>> >> >>
>>>>> >> >> >
>>>>> >> >> > The error was fatal due to not having been able to read c++
>>>>> version in gromacs library. It is reaching to the libgromacs.so file
>>>>> though.
>>>>> >> >> >
>>>>> >> >> > The error message is as follows:
>>>>> >> >> >
>>>>> >> >> > -- Looking for c++ gmx_version in
>>>>> /home/sbinkas/software/gromacs-2018.3/lib64/libgromacs.so
>>>>> >> >> > -- Looking for c++ gmx_version in
>>>>> /home/sbinkas/software/gromacs-2018.3/lib64/libgromacs.so - not found
>>>>> >> >> > CMake Error at csg/CMakeModules/FindGROMACS.cmake:57 (message):
>>>>> >> >> > Could not find a suitable gromacs library. gmx_version is
>>>>> not defined in
>>>>> >> >> > the gromacs library, that is very very strange, take a look
>>>>> at the error
>>>>> >> >> > message in
>>>>> /home/sbinkas/software/votca/build/CMakeFiles/CMakeError.log to
>>>>> >> >> > find out what was going wrong. This most likely means that
>>>>> your gromacs
>>>>> >> >> > version is too old, we need at least gromacs 2016!
>>>>> >> >> >
>>>>> >> >> > My version is 2018.3
>>>>> >> >> >
>>>>> >> >> > I have used this command for cmake:
>>>>> >> >> >
>>>>> >> >> > cmake -DBUILD_CSGAPPS=ON -DCMAKE_INSTALL_PREFIX=${prefix}
>>>>> -DWITH_GMX=ON ..
>>>>> >> >> >
>>>>> >> >> > Providing the path to include directory and library also
>>>>> makes no difference.
>>>>> >> >> >
>>>>> >> >> > However, I would note a caveat. The gromacs version I
>>>>> installed manually on cluster was installed with -DGMX_MPI=OFF.
>>>>> >> >> >
>>>>> >> >> > But, the dependencies requirement suggests gromacs-openmpi.
>>>>> Can that be a reason?
>>>>> >> >> Votca needs a non-mpi version, so that should be fine. You only
>>>>> need
>>>>> >> >> gromacs with mpi at runtime to do parallel simulations.
>>>>> >> >> Have a look at the end of
>>>>> >> >> /home/sbinkas/software/votca/build/CMakeFiles/CMakeError.log to
>>>>> see
>>>>> >> >> what is wrong with your libgromacs.
>>>>> >> >>
>>>>> >> >>
>>>>> >> >> > PS: I am talking about installation on cluster now. On local
>>>>> machine Votca package got installed using apt-get but as expected, the
>>>>> simulations were super slow.
>>>>> >> >> Usually you can speed up the gromacs simulation part by running
>>>>> on all cores.
>>>>> >> >>
>>>>> >> >> Christoph
>>>>> >> >> >
>>>>> >> >> > Thanks for all your help again.
>>>>> >> >> >
>>>>> >> >> > On Sat, Apr 25, 2020 at 9:41 AM Christoph Junghans <
>>>>> [email protected]> wrote:
>>>>> >> >> >>
>>>>> >> >> >> On Sat, Apr 25, 2020 at 7:15 AM Salman Bin Kashif <
>>>>> [email protected]> wrote:
>>>>> >> >> >> >
>>>>> >> >> >> > Okay. I will install a newer version manually and apt-get
>>>>> consider the 3.3-beta1 version to be the latest.
>>>>> >> >> >> That might help:
>>>>> >> >> >>
>>>>> https://askubuntu.com/questions/1068232/how-to-update-libeigen3-to-version-3-3-on-16-04-xenial
>>>>> >> >> >>
>>>>> >> >> >> >
>>>>> >> >> >> > My linux version is:
>>>>> >> >> >> >
>>>>> >> >> >> > Ubuntu 16.04.4 LTS
>>>>> >> >> >> Hmm, as the name suggests that Ubuntu is from 2016 and we
>>>>> will only
>>>>> >> >> >> support the latest LTS version, which currently is 18.04
>>>>> (until later
>>>>> >> >> >> this month when 20.04 LTS is released). We just don't have the
>>>>> >> >> >> manpower to support anything but the latest versions of most
>>>>> Linux
>>>>> >> >> >> distributions.
>>>>> >> >> >>
>>>>> >> >> >> Plus, the gromacs version in 16.04 might be also too old to
>>>>> be used
>>>>> >> >> >> with VOTCA-1.6.
>>>>> >> >> >>
>>>>> >> >> >> Christoph
>>>>> >> >> >> >
>>>>> >> >> >> > On Sat, Apr 25, 2020 at 9:10 AM Christoph Junghans <
>>>>> [email protected]> wrote:
>>>>> >> >> >> >>
>>>>> >> >> >> >> On Fri, Apr 24, 2020 at 10:07 PM Salman Bin Kashif <
>>>>> [email protected]> wrote:
>>>>> >> >> >> >> >
>>>>> >> >> >> >> > Thanks again for answering my questions.
>>>>> >> >> >> >> >
>>>>> >> >> >> >> > "What version do you have installed?"
>>>>> >> >> >> >> >
>>>>> >> >> >> >> > For eigen3, I have installed the version libeigen3-dev
>>>>> which is mentioned in the dependencies section. The version information
>>>>> for
>>>>> eigen3 is as follows:
>>>>> >> >> >> >> >
>>>>> >> >> >> >> > libeigen3-dev is already the newest version (3.3~beta1-2)
>>>>> >> >> >> >> Yes, and 3.3-beta1 is older than 3.3.0, so you need a
>>>>> newer version of eigen3.
>>>>> >> >> >> >>
>>>>> >> >> >> >> What Linux distribution are you using?
>>>>> >> >> >> >>
>>>>> >> >> >> >> Christoph
>>>>> >> >> >> >> >
>>>>> >> >> >> >> >
>>>>> >> >> >> >> > -Salman
>>>>> >> >> >> >> >
>>>>> >> >> >> >> >
>>>>> >> >> >> >> >
>>>>> >> >> >> >> > On Sat, Apr 25, 2020 at 12:00 AM Christoph Junghans <
>>>>> [email protected]> wrote:
>>>>> >> >> >> >> >>
>>>>> >> >> >> >> >>
>>>>> >> >> >> >> >>
>>>>> >> >> >> >> >> On Fri, Apr 24, 2020, 21:00 Salman Bin Kashif <
>>>>> [email protected]> wrote:
>>>>> >> >> >> >> >>>
>>>>> >> >> >> >> >>> Thank you, Christoph. I now tried installing v 1.6. I
>>>>> am trying on local machine for now since it is easier to install all the
>>>>> dependencies.
>>>>> >> >> >> >> >>>
>>>>> >> >> >> >> >>> Initially, my cmake version was old which was 3.5.1
>>>>> and on installing votca it was throwing an error that minimum 3.10 version
>>>>> is required for cmake. Hence I manually installed cmake version 3.16.5
>>>>> >> >> >> >> >>>
>>>>> >> >> >> >> >>> I verified cmake installation by checking the cmake
>>>>> --version
>>>>> >> >> >> >> >>>
>>>>> >> >> >> >> >>> However, on installing the votca back I got the
>>>>> following error:
>>>>> >> >> >> >> >>>
>>>>> >> >> >> >> >>> Could not find a configuration file for package
>>>>> "Eigen3" that is compatible
>>>>> >> >> >> >> >>> with requested version "3.3.0".
>>>>> >> >> >> >> >>>
>>>>> >> >> >> >> >>> The following configuration files were considered
>>>>> but not accepted:
>>>>> >> >> >> >> >>>
>>>>> >> >> >> >> >>> /usr/lib/cmake/eigen3/Eigen3Config.cmake, version:
>>>>> unknown
>>>>> >> >> >> >> >>
>>>>> >> >> >> >> >> This error means the Eigen3 you have installed is too
>>>>> old. Eigen-3.3.0 got released back in Nov. 2016, so that isn't very new
>>>>> either.
>>>>> >> >> >> >> >>
>>>>> >> >> >> >> >> What version do you have installed?
>>>>> >> >> >> >> >>
>>>>> >> >> >> >> >> Christoph
>>>>> >> >> >> >> >>
>>>>> >> >> >> >> >>>
>>>>> >> >> >> >> >>> Would I have to install specific cmake version?
>>>>> >> >> >> >> >>>
>>>>> >> >> >> >> >>>
>>>>> >> >> >> >> >>> On Fri, Apr 24, 2020 at 9:10 PM Christoph Junghans <
>>>>> [email protected]> wrote:
>>>>> >> >> >> >> >>>>
>>>>> >> >> >> >> >>>> Votca-1.4.1 was released back in Sept. 2017 and we
>>>>> don't really
>>>>> >> >> >> >> >>>> support such old versions anymore.
>>>>> >> >> >> >> >>>> If you don't have a strong reason to use v1.4.1 try
>>>>> to use Votca-1.6.
>>>>> >> >> >> >> >>>> see
>>>>> https://github.com/votca/votca/blob/master/README.md
>>>>> >> >> >> >> >>>>
>>>>> >> >> >> >> >>>>
>>>>> >> >> >> >> >>>> On Fri, Apr 24, 2020 at 6:59 PM Salman Bin Kashif <
>>>>> [email protected]> wrote:
>>>>> >> >> >> >> >>>> >
>>>>> >> >> >> >> >>>> > I am trying to Install Votca on cluster. In have
>>>>> loaded the required modules there. However, I am getting an error in terms
>>>>> of finding the package.I used the following command:
>>>>> >> >> >> >> >>>> >
>>>>> >> >> >> >> >>>> > cmake -DCMAKE_INSTALL_PREFIX=${prefix}
>>>>> -DWITH_FFTW=OFF -DWITH_SQLITE3=OFF ..
>>>>> >> >> >> >> >>>> >
>>>>> >> >> >> >> >>>> > The error message I get is:
>>>>> >> >> >> >> >>>> >
>>>>> >> >> >> >> >>>> > -- Boost version: 1.53.0
>>>>> >> >> >> >> >>>> > -- Found the following Boost libraries:
>>>>> >> >> >> >> >>>> > -- program_options
>>>>> >> >> >> >> >>>> > -- filesystem
>>>>> >> >> >> >> >>>> > -- system
>>>>> >> >> >> >> >>>> > -- checking for module 'gsl'
>>>>> >> >> >> >> >>>> > -- package 'gsl' not found
>>>>> >> >> >> >> >>>> > -- Could NOT find GSL (missing: GSL_LIBRARY
>>>>> GSL_INCLUDE_DIR)
>>>>> >> >> >> >> >>>> > -- Intel(R) MKL could not be found.
>>>>> >> >> >> >> >>>> > --
>>>>> >> >> >> >> >>>> > -- The following OPTIONAL packages have been found:
>>>>> >> >> >> >> >>>> >
>>>>> >> >> >> >> >>>> > * PkgConfig
>>>>> >> >> >> >> >>>> > * EXPAT
>>>>> >> >> >> >> >>>> > * Doxygen
>>>>> >> >> >> >> >>>> >
>>>>> >> >> >> >> >>>> > -- The following REQUIRED packages have been found:
>>>>> >> >> >> >> >>>> >
>>>>> >> >> >> >> >>>> > * Threads
>>>>> >> >> >> >> >>>> > * Boost (required version >= 1.39.0)
>>>>> >> >> >> >> >>>> >
>>>>> >> >> >> >> >>>> > -- The following OPTIONAL packages have not been
>>>>> found:
>>>>> >> >> >> >> >>>> >
>>>>> >> >> >> >> >>>> > * GSL
>>>>> >> >> >> >> >>>> > * MKL
>>>>> >> >> >> >> >>>> >
>>>>> >> >> >> >> >>>> > -- Could NOT find TXT2TAGS (missing:
>>>>> TXT2TAGS_EXECUTABLE)
>>>>> >> >> >> >> >>>> > txt2tags not found, help cmake to find it by
>>>>> setting TXT2TAGS_EXECUTABLE
>>>>> >> >> >> >> >>>> > -- Boost version: 1.53.0
>>>>> >> >> >> >> >>>> > -- Found the following Boost libraries:
>>>>> >> >> >> >> >>>> > -- program_options
>>>>> >> >> >> >> >>>> > -- filesystem
>>>>> >> >> >> >> >>>> > -- system
>>>>> >> >> >> >> >>>> > -- checking for module 'libvotca_tools'
>>>>> >> >> >> >> >>>> > -- package 'libvotca_tools' not found
>>>>> >> >> >> >> >>>> > CMake Error at
>>>>> /usr/share/cmake/Modules/FindPackageHandleStandardArgs.cmake:108
>>>>> (message):
>>>>> >> >> >> >> >>>> > Could NOT find SQLITE3 (missing:
>>>>> SQLITE3_INCLUDE_DIR)
>>>>> >> >> >> >> >>>> > Call Stack (most recent call first):
>>>>> >> >> >> >> >>>> >
>>>>> /usr/share/cmake/Modules/FindPackageHandleStandardArgs.cmake:315
>>>>> (_FPHSA_FAILURE_MESSAGE)
>>>>> >> >> >> >> >>>> > csg/CMakeModules/FindSQLITE3.cmake:34
>>>>> (find_package_handle_standard_args)
>>>>> >> >> >> >> >>>> > csg/CMakeModules/FindVOTCA_TOOLS.cmake:32
>>>>> (find_package)
>>>>> >> >> >> >> >>>> > csg/CMakeLists.txt:83 (find_package)
>>>>> >> >> >> >> >>>> Usually WITH_SQLITE3=OFF should disable the search
>>>>> for sqlite3,
>>>>> >> >> >> >> >>>> something funky is going on here as L32 in v1.4.1
>>>>> isn't actually
>>>>> >> >> >> >> >>>> checking for sqlite3:
>>>>> >> >> >> >> >>>>
>>>>> https://github.com/votca/csg/blob/v1.4.1/CMakeModules/FindVOTCA_CSG.cmake
>>>>> >> >> >> >> >>>> Please check you are using the correct version of csg.
>>>>> >> >> >> >> >>>>
>>>>> >> >> >> >> >>>> Christoph
>>>>> >> >> >> >> >>>> >
>>>>> >> >> >> >> >>>> >
>>>>> >> >> >> >> >>>> > -- Configuring incomplete, errors occurred!
>>>>> >> >> >> >> >>>> > See also
>>>>> "/home/sbinkas/votca/build/CMakeFiles/CMakeOutput.log".
>>>>> >> >> >> >> >>>> > See also
>>>>> "/home/sbinkas/votca/build/CMakeFiles/CMakeError.log".
>>>>> >> >> >> >> >>>> >
>>>>> >> >> >> >> >>>> >
>>>>> >> >> >> >> >>>> > --
>>>>> >> >> >> >> >>>> > Join us on Slack:
>>>>> https://join.slack.com/t/votca/signup
>>>>> >> >> >> >> >>>> > ---
>>>>> >> >> >> >> >>>> > You received this message because you are
>>>>> subscribed to the Google Groups "votca" group.
>>>>> >> >> >> >> >>>> > To unsubscribe from this group and stop receiving
>>>>> emails from it, send an email to [email protected].
>>>>> >> >> >> >> >>>> > To view this discussion on the web visit
>>>>> https://groups.google.com/d/msgid/votca/187cdc4c-6526-4716-8532-d60341aec7a1%40googlegroups.com
>>>>> .
>>>>> >> >> >> >> >>>>
>>>>> >> >> >> >> >>>>
>>>>> >> >> >> >> >>>>
>>>>> >> >> >> >> >>>> --
>>>>> >> >> >> >> >>>> Christoph Junghans
>>>>> >> >> >> >> >>>> Web: http://www.compphys.de
>>>>> >> >> >> >> >>>>
>>>>> >> >> >> >> >>>> --
>>>>> >> >> >> >> >>>> Join us on Slack:
>>>>> https://join.slack.com/t/votca/signup
>>>>> >> >> >> >> >>>> ---
>>>>> >> >> >> >> >>>> You received this message because you are subscribed
>>>>> to the Google Groups "votca" group.
>>>>> >> >> >> >> >>>> To unsubscribe from this group and stop receiving
>>>>> emails from it, send an email to [email protected].
>>>>> >> >> >> >> >>>> To view this discussion on the web visit
>>>>> https://groups.google.com/d/msgid/votca/CAHG27e5T9%2BYxURMfUrr8nVyERKqD1yMGGRMONw09eNeUggHNew%40mail.gmail.com
>>>>> .
>>>>> >> >> >> >> >>>
>>>>> >> >> >> >> >>> --
>>>>> >> >> >> >> >>> Join us on Slack:
>>>>> https://join.slack.com/t/votca/signup
>>>>> >> >> >> >> >>> ---
>>>>> >> >> >> >> >>> You received this message because you are subscribed
>>>>> to the Google Groups "votca" group.
>>>>> >> >> >> >> >>> To unsubscribe from this group and stop receiving
>>>>> emails from it, send an email to [email protected].
>>>>> >> >> >> >> >>> To view this discussion on the web visit
>>>>> https://groups.google.com/d/msgid/votca/CAFwyQHy-N%3DpNKX4tQ-KXSU6Aghh23Af%2Bg_M1pJiAB8KsQAi-UQ%40mail.gmail.com
>>>>> .
>>>>> >> >> >> >> >>
>>>>> >> >> >> >> >> --
>>>>> >> >> >> >> >> Join us on Slack: https://join.slack.com/t/votca/signup
>>>>> >> >> >> >> >> ---
>>>>> >> >> >> >> >> You received this message because you are subscribed to
>>>>> the Google Groups "votca" group.
>>>>> >> >> >> >> >> To unsubscribe from this group and stop receiving
>>>>> emails from it, send an email to [email protected].
>>>>> >> >> >> >> >> To view this discussion on the web visit
>>>>> https://groups.google.com/d/msgid/votca/CAHG27e4RwoWm-NDRSYAZPzycT%3DKAoOnK-HZ8JYVCC0Ej5X_%2BEA%40mail.gmail.com
>>>>> .
>>>>> >> >> >> >> >
>>>>> >> >> >> >> > --
>>>>> >> >> >> >> > Join us on Slack: https://join.slack.com/t/votca/signup
>>>>> >> >> >> >> > ---
>>>>> >> >> >> >> > You received this message because you are subscribed to
>>>>> the Google Groups "votca" group.
>>>>> >> >> >> >> > To unsubscribe from this group and stop receiving emails
>>>>> from it, send an email to [email protected].
>>>>> >> >> >> >> > To view this discussion on the web visit
>>>>> https://groups.google.com/d/msgid/votca/CAFwyQHwpcxE%3D%3DZK%3D2Udw9fSFpn3d2rkCk1COVSpY5MaDQ_TpCw%40mail.gmail.com
>>>>> .
>>>>> >> >> >> >>
>>>>> >> >> >> >>
>>>>> >> >> >> >>
>>>>> >> >> >> >> --
>>>>> >> >> >> >> Christoph Junghans
>>>>> >> >> >> >> Web: http://www.compphys.de
>>>>> >> >> >> >>
>>>>> >> >> >> >> --
>>>>> >> >> >> >> Join us on Slack: https://join.slack.com/t/votca/signup
>>>>> >> >> >> >> ---
>>>>> >> >> >> >> You received this message because you are subscribed to
>>>>> the Google Groups "votca" group.
>>>>> >> >> >> >> To unsubscribe from this group and stop receiving emails
>>>>> from it, send an email to [email protected].
>>>>> >> >> >> >> To view this discussion on the web visit
>>>>> https://groups.google.com/d/msgid/votca/CAHG27e7T7i1nF%3DJj_O4aPEJh6JmEomSn_mLn2kRXW9Q_N7fq%2Bg%40mail.gmail.com
>>>>> .
>>>>> >> >> >> >
>>>>> >> >> >> > --
>>>>> >> >> >> > Join us on Slack: https://join.slack.com/t/votca/signup
>>>>> >> >> >> > ---
>>>>> >> >> >> > You received this message because you are subscribed to the
>>>>> Google Groups "votca" group.
>>>>> >> >> >> > To unsubscribe from this group and stop receiving emails
>>>>> from it, send an email to [email protected].
>>>>> >> >> >> > To view this discussion on the web visit
>>>>> https://groups.google.com/d/msgid/votca/CAFwyQHzzXw%2ByX-ggrOJpXS7p1y0NoWpYrT658Bky%2B9_UW3Kneg%40mail.gmail.com
>>>>> .
>>>>> >> >> >>
>>>>> >> >> >>
>>>>> >> >> >>
>>>>> >> >> >> --
>>>>> >> >> >> Christoph Junghans
>>>>> >> >> >> Web: http://www.compphys.de
>>>>> >> >> >>
>>>>> >> >> >> --
>>>>> >> >> >> Join us on Slack: https://join.slack.com/t/votca/signup
>>>>> >> >> >> ---
>>>>> >> >> >> You received this message because you are subscribed to the
>>>>> Google Groups "votca" group.
>>>>> >> >> >> To unsubscribe from this group and stop receiving emails from
>>>>> it, send an email to [email protected].
>>>>> >> >> >> To view this discussion on the web visit
>>>>> https://groups.google.com/d/msgid/votca/CAHG27e5bXjZrLsJQUBTRAE3T%2BMs4Unrk3SzCzUp_ZZYCHXXnCA%40mail.gmail.com
>>>>> .
>>>>> >> >> >
>>>>> >> >> > --
>>>>> >> >> > Join us on Slack: https://join.slack.com/t/votca/signup
>>>>> >> >> > ---
>>>>> >> >> > You received this message because you are subscribed to the
>>>>> Google Groups "votca" group.
>>>>> >> >> > To unsubscribe from this group and stop receiving emails from
>>>>> it, send an email to [email protected].
>>>>> >> >> > To view this discussion on the web visit
>>>>> https://groups.google.com/d/msgid/votca/CAFwyQHy91W4YdUGKiYrispvdjrfSQhSFHKrWMubs4X8uDGexTQ%40mail.gmail.com
>>>>> .
>>>>> >> >>
>>>>> >> >>
>>>>> >> >>
>>>>> >> >> --
>>>>> >> >> Christoph Junghans
>>>>> >> >> Web: http://www.compphys.de
>>>>> >> >>
>>>>> >> >> --
>>>>> >> >> Join us on Slack: https://join.slack.com/t/votca/signup
>>>>> >> >> ---
>>>>> >> >> You received this message because you are subscribed to the
>>>>> Google Groups "votca" group.
>>>>> >> >> To unsubscribe from this group and stop receiving emails from
>>>>> it, send an email to [email protected].
>>>>> >> >> To view this discussion on the web visit
>>>>> https://groups.google.com/d/msgid/votca/CAHG27e7KT6hGWYuOTO%3DwVTkgpBG9DWQWes7FQ8DmB%3DexmZ0x0g%40mail.gmail.com
>>>>> .
>>>>> >> >
>>>>> >> > --
>>>>> >> > Join us on Slack: https://join.slack.com/t/votca/signup
>>>>> >> > ---
>>>>> >> > You received this message because you are subscribed to the
>>>>> Google Groups "votca" group.
>>>>> >> > To unsubscribe from this group and stop receiving emails from it,
>>>>> send an email to [email protected].
>>>>> >> > To view this discussion on the web visit
>>>>> https://groups.google.com/d/msgid/votca/CAFwyQHzq6TrBChPWMEdpKKid8CoLLbb555weSia_SHzx4tX%3D5A%40mail.gmail.com
>>>>> .
>>>>> >>
>>>>> >>
>>>>> >>
>>>>> >> --
>>>>> >> Christoph Junghans
>>>>> >> Web: http://www.compphys.de
>>>>> >>
>>>>> >> --
>>>>> >> Join us on Slack: https://join.slack.com/t/votca/signup
>>>>> >> ---
>>>>> >> You received this message because you are subscribed to the Google
>>>>> Groups "votca" group.
>>>>> >> To unsubscribe from this group and stop receiving emails from it,
>>>>> send an email to [email protected].
>>>>> >> To view this discussion on the web visit
>>>>> https://groups.google.com/d/msgid/votca/CAHG27e7mfQb%2BC5Cfq2RtFtzZiNDHXNeAR8rFqzYq%2BbAg1SGjqw%40mail.gmail.com
>>>>> .
>>>>> >
>>>>> > --
>>>>> > Join us on Slack: https://join.slack.com/t/votca/signup
>>>>> > ---
>>>>> > You received this message because you are subscribed to the Google
>>>>> Groups "votca" group.
>>>>> > To unsubscribe from this group and stop receiving emails from it,
>>>>> send an email to [email protected].
>>>>> > To view this discussion on the web visit
>>>>> https://groups.google.com/d/msgid/votca/CAFwyQHy4vWM9Ceaw5scKKeY-fJd0kMBPYziKsLw6qarkNS%3DR9w%40mail.gmail.com
>>>>> .
>>>>>
>>>>>
>>>>>
>>>>> --
>>>>> Christoph Junghans
>>>>> Web: http://www.compphys.de
>>>>>
>>>>> --
>>>>> Join us on Slack: https://join.slack.com/t/votca/signup
>>>>> ---
>>>>> You received this message because you are subscribed to the Google
>>>>> Groups "votca" group.
>>>>> To unsubscribe from this group and stop receiving emails from it, send
>>>>> an email to [email protected].
>>>>>
>>>> To view this discussion on the web visit
>>>>> https://groups.google.com/d/msgid/votca/CAHG27e4dei82q8VEfajeWidKeRE4m%2BC0h9haLw6j_7qdQ60ixQ%40mail.gmail.com
>>>>> .
>>>>>
>>>> --
>>>> Join us on Slack: https://join.slack.com/t/votca/signup
>>>> ---
>>>> You received this message because you are subscribed to the Google
>>>> Groups "votca" group.
>>>> To unsubscribe from this group and stop receiving emails from it, send
>>>> an email to [email protected].
>>>> To view this discussion on the web visit
>>>> https://groups.google.com/d/msgid/votca/CAFwyQHyvibXKzOp4e4ig-Lv331HkdZ2X9Titsjvt_ooMiqrQPg%40mail.gmail.com
>>>> <https://groups.google.com/d/msgid/votca/CAFwyQHyvibXKzOp4e4ig-Lv331HkdZ2X9Titsjvt_ooMiqrQPg%40mail.gmail.com?utm_medium=email&utm_source=footer>
>>>> .
>>>>
>>> --
>>> Christoph Junghans
>>> Web: http://www.compphys.de
>>>
>>> --
>>> Join us on Slack: https://join.slack.com/t/votca/signup
>>> ---
>>> You received this message because you are subscribed to the Google
>>> Groups "votca" group.
>>> To unsubscribe from this group and stop receiving emails from it, send
>>> an email to [email protected].
>>>
>> To view this discussion on the web visit
>>> https://groups.google.com/d/msgid/votca/CAHG27e7MxFV6fc2WDU0%3D8%2BL%3D%2B4mgaZr4LZ6APYdEqYmtsmmJpA%40mail.gmail.com
>>> <https://groups.google.com/d/msgid/votca/CAHG27e7MxFV6fc2WDU0%3D8%2BL%3D%2B4mgaZr4LZ6APYdEqYmtsmmJpA%40mail.gmail.com?utm_medium=email&utm_source=footer>
>>> .
>>>
>> --
>> Join us on Slack: https://join.slack.com/t/votca/signup
>> ---
>> You received this message because you are subscribed to the Google Groups
>> "votca" group.
>> To unsubscribe from this group and stop receiving emails from it, send an
>> email to [email protected].
>> To view this discussion on the web visit
>> https://groups.google.com/d/msgid/votca/CAFwyQHym1V1DDWnoqELvtNPbFE%3D%2B7KSTE-RCKM2aVArgF5YdRw%40mail.gmail.com
>> <https://groups.google.com/d/msgid/votca/CAFwyQHym1V1DDWnoqELvtNPbFE%3D%2B7KSTE-RCKM2aVArgF5YdRw%40mail.gmail.com?utm_medium=email&utm_source=footer>
>> .
>>
> --
> Christoph Junghans
> Web: http://www.compphys.de
>
> --
> Join us on Slack: https://join.slack.com/t/votca/signup
> ---
> You received this message because you are subscribed to the Google Groups
> "votca" group.
> To unsubscribe from this group and stop receiving emails from it, send an
> email to [email protected].
> To view this discussion on the web visit
> https://groups.google.com/d/msgid/votca/CAHG27e4gh80z%3DUPL8nydGrEm3QV0HqRzYm7cozObdZJZR1QZLA%40mail.gmail.com
> <https://groups.google.com/d/msgid/votca/CAHG27e4gh80z%3DUPL8nydGrEm3QV0HqRzYm7cozObdZJZR1QZLA%40mail.gmail.com?utm_medium=email&utm_source=footer>
> .
>
--
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---
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