On Sat, Apr 25, 2020 at 2:30 PM Salman Bin Kashif <[email protected]> wrote: > > I am still getting errors in the make -j5 command. I am not sure which branch > should I pull the changes from. The modules changed in the above mentioned > pull doesn't seem to have changed in my local copy. I am pulling from stable > branch. If haven't merge the patch yet, try to go into the csg folder and do: $ git remote update $ git checkout for/stable/fftw_fix to change the code.
Christoph > > Initially, I have cloned for version v1.6 > > On Sat, Apr 25, 2020 at 4:03 PM Salman Bin Kashif <[email protected]> > wrote: >> >> Thank you. I tried the seI guess there may be another issue. I used the >> following command: >> >> cmake -DBUILD_CSGAPPS=ON -DCMAKE_INSTALL_PREFIX=${prefix} -DWITH_GMX=ON >> -DGROMACS_INCLUDE_DIR=/home/sbinkas/software/gromacs-2018.3/include >> -DGROMACS_LIBRARY=/home/sbinkas/software/gromacs-2018.3/lib64/libgromacs.so >> -DCMAKE_DISABLE_FIND_PACKAGE_FFTW3=ON >> -DCMAKE_PREFIX_PATH=/home/sbinkas/software .. >> >> cmake command runs fine. >> >> make -j5 throws the error >> >> Error looks like: >> >> ../libtools/libvotca_tools.so.6: undefined reference to >> `boost::program_options::option_description::format_name[abi:cxx11][ 66%] >> Built target votca_csg >> make: *** [all] Error 2 >> >> Am I missing something? >> >> In the meanwhile, I will try with option 1. >> >> On Sat, Apr 25, 2020 at 3:46 PM Salman Bin Kashif <[email protected]> >> wrote: >>> >>> Thanks so much. I wiil try using the disable package option first. >>> >>> On Sat, Apr 25, 2020 at 2:09 PM Salman Bin Kashif <[email protected]> >>> wrote: >>>> >>>> Following is the output of make VERBOSE-1 >>>> >>>> [sbinkas@node0170 build]$ make VERBOSE=1 >>>> /software/cmake/3.10.0/bin/cmake -H/home/sbinkas/software/votca >>>> -B/home/sbinkas/software/votca/build --check-build-system >>>> CMakeFiles/Makefile.cmake 0 >>>> /software/cmake/3.10.0/bin/cmake -E cmake_progress_start >>>> /home/sbinkas/software/votca/build/CMakeFiles >>>> /home/sbinkas/software/votca/build/CMakeFiles/progress.marks >>>> make -f CMakeFiles/Makefile2 all >>>> make[1]: Entering directory `/home/sbinkas/software/votca/build' >>>> make -f tools/share/man/CMakeFiles/votca_tools_manpages.dir/build.make >>>> tools/share/man/CMakeFiles/votca_tools_manpages.dir/depend >>>> make[2]: Entering directory `/home/sbinkas/software/votca/build' >>>> cd /home/sbinkas/software/votca/build && /software/cmake/3.10.0/bin/cmake >>>> -E cmake_depends "Unix Makefiles" /home/sbinkas/software/votca >>>> /home/sbinkas/software/votca/tools/share/man >>>> /home/sbinkas/software/votca/build >>>> /home/sbinkas/software/votca/build/tools/share/man >>>> /home/sbinkas/software/votca/build/tools/share/man/CMakeFiles/votca_tools_manpages.dir/DependInfo.cmake >>>> --color= >>>> make[2]: Leaving directory `/home/sbinkas/software/votca/build' >>>> make -f tools/share/man/CMakeFiles/votca_tools_manpages.dir/build.make >>>> tools/share/man/CMakeFiles/votca_tools_manpages.dir/build >>>> make[2]: Entering directory `/home/sbinkas/software/votca/build' >>>> make[2]: Nothing to be done for >>>> `tools/share/man/CMakeFiles/votca_tools_manpages.dir/build'. >>>> make[2]: Leaving directory `/home/sbinkas/software/votca/build' >>>> [ 0%] Built target votca_tools_manpages >>>> make -f tools/src/libtools/CMakeFiles/gitversion.dir/build.make >>>> tools/src/libtools/CMakeFiles/gitversion.dir/depend >>>> make[2]: Entering directory `/home/sbinkas/software/votca/build' >>>> cd /home/sbinkas/software/votca/build && /software/cmake/3.10.0/bin/cmake >>>> -E cmake_depends "Unix Makefiles" /home/sbinkas/software/votca >>>> /home/sbinkas/software/votca/tools/src/libtools >>>> /home/sbinkas/software/votca/build >>>> /home/sbinkas/software/votca/build/tools/src/libtools >>>> /home/sbinkas/software/votca/build/tools/src/libtools/CMakeFiles/gitversion.dir/DependInfo.cmake >>>> --color= >>>> make[2]: Leaving directory `/home/sbinkas/software/votca/build' >>>> make -f tools/src/libtools/CMakeFiles/gitversion.dir/build.make >>>> tools/src/libtools/CMakeFiles/gitversion.dir/build >>>> make[2]: Entering directory `/home/sbinkas/software/votca/build' >>>> cd /home/sbinkas/software/votca/build/tools/src/libtools && >>>> /software/cmake/3.10.0/bin/cmake >>>> -DTOP_SOURCE_DIR="/home/sbinkas/software/votca" >>>> -DGIT_EXECUTABLE="/bin/git" -P >>>> /home/sbinkas/software/votca/tools/CMakeModules/gitversion.cmake >>>> Current git revision is 98e27cd >>>> make[2]: Leaving directory `/home/sbinkas/software/votca/build' >>>> [ 0%] Built target gitversion >>>> make -f tools/src/libtools/CMakeFiles/votca_tools.dir/build.make >>>> tools/src/libtools/CMakeFiles/votca_tools.dir/depend >>>> make[2]: Entering directory `/home/sbinkas/software/votca/build' >>>> cd /home/sbinkas/software/votca/build && /software/cmake/3.10.0/bin/cmake >>>> -E cmake_depends "Unix Makefiles" /home/sbinkas/software/votca >>>> /home/sbinkas/software/votca/tools/src/libtools >>>> /home/sbinkas/software/votca/build >>>> /home/sbinkas/software/votca/build/tools/src/libtools >>>> /home/sbinkas/software/votca/build/tools/src/libtools/CMakeFiles/votca_tools.dir/DependInfo.cmake >>>> --color= >>>> make[2]: Leaving directory `/home/sbinkas/software/votca/build' >>>> make -f tools/src/libtools/CMakeFiles/votca_tools.dir/build.make >>>> tools/src/libtools/CMakeFiles/votca_tools.dir/build >>>> make[2]: Entering directory `/home/sbinkas/software/votca/build' >>>> make[2]: Nothing to be done for >>>> `tools/src/libtools/CMakeFiles/votca_tools.dir/build'. >>>> make[2]: Leaving directory `/home/sbinkas/software/votca/build' >>>> [ 27%] Built target votca_tools >>>> make -f tools/src/tools/CMakeFiles/votca_property.dir/build.make >>>> tools/src/tools/CMakeFiles/votca_property.dir/depend >>>> make[2]: Entering directory `/home/sbinkas/software/votca/build' >>>> cd /home/sbinkas/software/votca/build && /software/cmake/3.10.0/bin/cmake >>>> -E cmake_depends "Unix Makefiles" /home/sbinkas/software/votca >>>> /home/sbinkas/software/votca/tools/src/tools >>>> /home/sbinkas/software/votca/build >>>> /home/sbinkas/software/votca/build/tools/src/tools >>>> /home/sbinkas/software/votca/build/tools/src/tools/CMakeFiles/votca_property.dir/DependInfo.cmake >>>> --color= >>>> make[2]: Leaving directory `/home/sbinkas/software/votca/build' >>>> make -f tools/src/tools/CMakeFiles/votca_property.dir/build.make >>>> tools/src/tools/CMakeFiles/votca_property.dir/build >>>> make[2]: Entering directory `/home/sbinkas/software/votca/build' >>>> [ 28%] Building CXX object >>>> tools/src/tools/CMakeFiles/votca_property.dir/votca_property.cc.o >>>> cd /home/sbinkas/software/votca/build/tools/src/tools && >>>> /software/gcc/5.4.0/bin/g++ -I/home/sbinkas/software/votca/tools/include >>>> -I/home/sbinkas/software/votca/build/tools/include -isystem >>>> /home/sbinkas/software/include/eigen3 -Wall -Wextra -Wpedantic -Wshadow >>>> -Wconversion -O3 -DNDEBUG -std=c++14 -o >>>> CMakeFiles/votca_property.dir/votca_property.cc.o -c >>>> /home/sbinkas/software/votca/tools/src/tools/votca_property.cc >>>> In file included from >>>> /home/sbinkas/software/votca/tools/include/votca/tools/eigen.h:52:0, >>>> from >>>> /home/sbinkas/software/votca/tools/include/votca/tools/property.h:21, >>>> from >>>> /home/sbinkas/software/votca/tools/include/votca/tools/application.h:21, >>>> from >>>> /home/sbinkas/software/votca/tools/src/tools/votca_property.cc:22: >>>> /home/sbinkas/software/include/eigen3/unsupported/Eigen/FFT:75:21: fatal >>>> error: fftw3.h: No such file or directory >>>> compilation terminated. >>>> make[2]: *** >>>> [tools/src/tools/CMakeFiles/votca_property.dir/votca_property.cc.o] Error 1 >>>> make[2]: Leaving directory `/home/sbinkas/software/votca/build' >>>> make[1]: *** [tools/src/tools/CMakeFiles/votca_property.dir/all] Error 2 >>>> make[1]: Leaving directory `/home/sbinkas/software/votca/build' >>>> 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. >>>>>>> >>>>>>> -- >>>>>>> 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. >>>>>> >>>>>> -- >>>>>> 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. >>>>> >>>>> -- >>>>> 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. > > -- > 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/CAFwyQHzhzLokv_xK6rMEcbpTjOgXX1pTrSGq-bQAs8QQu_uKog%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/CAHG27e6CnTrUFkzfwQkspUDLBam9-6Ht4dGHy0CgSHA2ktxQSA%40mail.gmail.com.
