Dear Christoph,

Thanks for your suggestions and I am sorry for the late reply: I was 
travelling last two weeks and were not able to try your suggestions.

When running strings -a /path/to/libboost_program_options.so | grep GCC, I 
got:
GCC_3.0
GCC: (GNU) 4.4.7 20120313 (Red Hat 4.4.7-11)
GCC: (GNU) 6.1.0 
_Unwind_Resume@@GCC_3.0
Does this means my boost is not installed by gcc-6.1? I don't why it shows 
several versions of gcc. Even when I compile the boost with  ./bootstrap.sh 
--with-toolset=gcc,  ./b2 --toolset=gcc-6.1.0, I got the same information. 

Also, you recommended me to install boost in another directory, but in this 
case, votca can not find the boost package even when I specified the path 
of boost header files and libraries as I mention before. Do you have any 
ideas on why this happens?

The spack option has also been tried, while I also did not success to 
install votca-csg. The corresponding on screen information and log files 
are attached. Besides, it seems votca-ctp is not involved in spack (I tried 
to append votca-ctp after the commend but it says it can not find the 
votca-ctp package), while this is actually the one I needed.

Your further help is greatly appreciated.
Best regards,
Shiyun


在 2017年5月28日星期日 UTC+8上午5:24:27,Christoph Junghans写道:
>
> 2017-05-26 21:02 GMT-06:00 Shiyun Xiong <[email protected] <javascript:>>: 
>
> > Dear Christoph, 
> > 
> > Thanks a lot for providing the solutions. 
> > For the first point of using the system gcc and boost: my system gcc 
> > (/usr/bin/gcc) version is 4.4.7 released in 2012, hence it is rather 
> old. 
> > Also, I can not find (I don't know) where is the system boost header 
> files 
> > although I can find the system boost library is in the /usr/lib64/ fold. 
> > Most importantly, as mentioned in my first post, when the boost paths 
> are 
> > specified during the votca installation, it says can not find the 
> required 
> > boost package. As a result, I haven't try this solution! 
> Yes, gcc-4.4.7 would also not support C++11, gcc-4.8 is the first one 
> supporting enough of it to compile VOTCA. 
> > 
> > The second method of using another boost version with the same gcc 
> compiler 
> > as votca: I actually using the default gcc to compile both Boost and 
> Votca 
> > (which gcc --> /usr/local/bin/gcc   gcc --version  --> gcc (GCC) 6.1.0). 
> So 
> > I think the gcc used to compile both BOOST and votca is the same. Using 
> the 
> > default gcc, I now installed the BOOST 1.62.0 version. However, the 
> > "undefined reference" error still appears. For gcc 6.1, I checked it 
> support 
> > the c++11 standard. 
> Something seems broken here, if you are lucky 
> $ strings -a /path/to/libboost_program_options.so | grep GCC 
> will reveal to you, which gcc was used to compile boost. 
>
> But I would try to recompile boost in another directory using gcc-6.1 
>
> I recently added votca to spack, so you might have a chance to install 
> it that way: 
> <https://github.com/votca/csg/wiki/Installing#spack> 
>
> Christoph 
> > 
> > For the third one: my system is Centos, it seems there is not votca 
> install. 
> > 
> > Best Regards, 
> > Shiyun 
> > 
> > 
> > 在 2017年5月27日星期六 UTC+8上午12:22:32,Christoph Junghans写道: 
> >> 
> >> 2017-05-26 4:23 GMT-06:00 Shiyun Xiong <[email protected]>: 
> >> > Dear Christoph, 
> >> > 
> >> > I have install the latest BOOST version 1.64.0. However, I have 
> >> > encountered 
> >> > other errors: 'Make_array' is not a member of 'boost::serialization'. 
> >> Yup, boost 1.64.0 has a bug (see here: 
> >> <https://svn.boost.org/trac/boost/ticket/12516>), which has nothing to 
> >> do with VOTCA. 1.64 is very new release and hence not very well 
> >> tested. 
> >> 
> >> > In fact, I have used this version of BOOST at the beginning and this 
> >> > error 
> >> > occured. Denis suggested me to downgrade my boost version and I found 
> >> > from 
> >> > the votca website that 1.53 is a recommanded version. That's why I 
> used 
> >> > 1.53 
> >> Ok, let me try to clarify. VOTCA works pretty much works with any gcc 
> >> and boost version (except may the above mentioned boost-1.64.0). 
> >> 
> >> However, VOTCA (from version 1.4on ) uses C++-11 features and hence 
> >> depends on C++-11 ABI. Unfortunately, <=gcc-4.9, gcc-5* and >=gcc-6 
> >> have 3 different C++-11 ABIs and hence you will get the "undefined 
> >> reference" error from above when trying to link VOTCA against a boost, 
> >> which was built with a different C++-11 ABI. 
> >> 
> >> There are multiple solutions to that issue: 
> >> 1.) Use the system (NOT /usr/local) gcc and boost - usually the Linux 
> >> distributions get their thing together nicely. 
> >> 2.) Use a (non-buggy) boost version, which is compiled with SAME 
> >> compiler as you are compiling VOTCA with. 
> >> 3.) If you don't need the development version of VOTCA, just use the 
> >> package, which comes with your linux distributions - OpenSuse, Fedora, 
> >> Debian, Ubuntu have VOTCA packages. See 
> >> <https://github.com/votca/csg/wiki/Installing> 
> >> 
> >> Christoph 
> >> 
> >> > 
> >> > Attached are the on screen information and cmake error information. 
> >> > Please 
> >> > check it. Thank you so much! 
> >> > 
> >> > Best regards, 
> >> > Shiyun 
> >> > 
> >> > 
> >> > 在 2017年5月24日星期三 UTC+8下午9:53:25,Christoph Junghans写道: 
> >> >> 
> >> >> 2017-05-24 2:00 GMT-06:00 Bensen-zjg Zhang <[email protected]>: 
> >> >> > Dear VOTCA developers and users, 
> >> >> > 
> >> >> > 
> >> >> > I am trying to install the VOTCA software with build.sh on Centos 
> >> >> > system 
> >> >> > but 
> >> >> > encountered some errors. Before install votca, I have installed 
> all 
> >> >> > the 
> >> >> > dependencies: Boost, Git, GSL, FFTW3, EXPAT, PkgConfig, SQLITE3, 
> >> >> > Doxygen, 
> >> >> > Gromacs. The gcc version is 6.1.0 and the current boost version is 
> >> >> > 1.53.0. 
> >> >> > The installation command I used is: 
> >> >> > 
> >> >> > ./build.sh --prefix /usr/local/votca/ 
> >> >> > -DFFTW3_INCLUDE_DIR=/usr/local/fftw_shared/include/ 
> >> >> > -DFFTW3_LIBRARY=/usr/local/fftw_shared/lib/libfftw3.so --dev tools 
> >> >> > csg 
> >> >> > kmc 
> >> >> > moo ctp ctp-tutorials ctp-manual 
> >> >> > 
> >> >> > With this building command, I got the following error information: 
> >> >> > /usr/local/lib/libboost_program_options.so: undefined reference to 
> >> >> > `std::__cxx11::basic_string<char, std::char_traits<char>, 
> >> >> > std::allocator<char> >::~basic_string()@GLIBCXX_3.4.21' 
> >> >> Errors like these usually mean your boost has been compiled with an 
> >> >> older (ABI-incompatible) version of gcc. 
> >> >> (I am guessing so, as you are using gcc-6.1 which relatively recent, 
> >> >> while boost-1.53 is actually more than 4 years old.) 
> >> >> 
> >> >> See the troubleshooting block of 
> >> >> 
> >> >> 
> >> >> 
> https://gcc.gnu.org/onlinedocs/gcc-5.2.0/libstdc++/manual/manual/using_dual_abi.html
>  
> >> >> for details. 
> >> >> 
> >> >> Just install a newer version of boost using your gcc-6.1 and have 
> >> >> VOTCA compile against that one. 
> >> >> 
> >> >> Christoph 
> >> >> 
> >> >> 
> >> >> 
> >> >> > /usr/local/lib/libboost_program_options.so: undefined reference to 
> >> >> > `std::logic_error::logic_error(std::__cxx11::basic_string<char, 
> >> >> > std::char_traits<char>, std::allocator<char> > 
> >> >> > const&)@GLIBCXX_3.4.21' 
> >> >> > /usr/local/lib/libboost_program_options.so: undefined reference to 
> >> >> > `std::__cxx11::basic_string<wchar_t, std::char_traits<wchar_t>, 
> >> >> > std::allocator<wchar_t> >::~basic_string()@GLIBCXX_3.4.21' 
> >> >> > /usr/local/lib/libboost_program_options.so: undefined reference to 
> >> >> > `operator 
> >> >> > delete(void*, unsigned long)@CXXABI_1.3.9' 
> >> >> > /usr/local/lib/libboost_program_options.so: undefined reference to 
> >> >> > `std::__cxx11::basic_string<char, std::char_traits<char>, 
> >> >> > std::allocator<char> >::_M_replace(unsigned long, unsigned long, 
> char 
> >> >> > const*, unsigned long)@GLIBCXX_3.4.21' 
> >> >> > /usr/local/lib/libboost_program_options.so: undefined reference to 
> >> >> > `std::__cxx11::basic_string<char, std::char_traits<char>, 
> >> >> > std::allocator<char> >::find(char const*, unsigned long, unsigned 
> >> >> > long) 
> >> >> > const@GLIBCXX_3.4.21' 
> >> >> > /usr/local/lib/libboost_filesystem.so: undefined reference to 
> >> >> > `std::__cxx11::basic_string<char, std::char_traits<char>, 
> >> >> > std::allocator<char> >::rfind(char, unsigned long) 
> >> >> > const@GLIBCXX_3.4.21' 
> >> >> > collect2: ld returned 1 exit status 
> >> >> > make[2]: *** [src/tools/votca_property] Error 1 
> >> >> > make[1]: *** [src/tools/CMakeFiles/votca_property.dir/all] Error 2 
> >> >> > make: *** [all] Error 2 
> >> >> > 
> >> >> > When searching from the previous discussions, I found that I may 
> need 
> >> >> > to 
> >> >> > specify the Boost path. As a result, I tried: 
> >> >> > 
> >> >> > ./build.sh --prefix /usr/local/votca/ 
> >> >> > -DFFTW3_INCLUDE_DIR=/usr/local/fftw_shared/include/ 
> >> >> > -DFFTW3_LIBRARY=/usr/local/fftw_shared/lib/libfftw3.so 
> >> >> > -DBoost_INCLUDE_DIR=/usr/local/include/boost/ 
> >> >> > 
> >> >> > 
> >> >> > 
> -DBoost_PROGRAM_OPTIONS_LIBRARY=/usr/local/lib/libboost_program_options.so 
> >> >> > -DBoost_FILESYSTEM_LIBRARY=/usr/local/lib/libboost_filesystem.so 
> >> >> > --dev 
> >> >> > tools 
> >> >> > csg kmc moo ctp ctp-tutorials ctp-manual 
> >> >> > 
> >> >> > 
> >> >> > This time, votca can not find the boost package? I have no idea 
> why 
> >> >> > it 
> >> >> > can 
> >> >> > not find boost since I have specified the path to it! 
> >> >> > For more information, I have attached the entire on screen printed 
> >> >> > information and the cmake error file. The file names with 
> >> >> > "_noBoostPath" 
> >> >> > correspond to the first building command (no boost path is 
> specified) 
> >> >> > while 
> >> >> > the file names with "_withBoostPath" correspond to the second 
> >> >> > building 
> >> >> > command. 
> >> >> > 
> >> >> > By the way, when using the second building command, votca find 
> both 
> >> >> > GSL 
> >> >> > and 
> >> >> > MKL libraries, so I have also tried to disable the mkl library 
> with 
> >> >> > -DCMAKE_DISABLE_FIND_PACKAGE_MKL=ON, but not change happens. 
> >> >> > 
> >> >> > Thank you very much for your kind help! 
> >> >> > With best regards, 
> >> >> > Shiyun 
> >> >> > 
> >> >> > -- 
> >> >> > 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 post to this group, send email to [email protected]. 
> >> >> > Visit this group at https://groups.google.com/group/votca. 
> >> >> > For more options, visit https://groups.google.com/d/optout. 
> >> >> 
> >> >> 
> >> >> 
> >> >> -- 
> >> >> Christoph Junghans 
> >> >> Web: http://www.compphys.de 
> >> > 
> >> > -- 
> >> > 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 post to this group, send email to [email protected]. 
> >> > Visit this group at https://groups.google.com/group/votca. 
> >> > For more options, visit https://groups.google.com/d/optout. 
> >> 
> >> 
> >> 
> >> -- 
> >> Christoph Junghans 
> >> Web: http://www.compphys.de 
> > 
> > -- 
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> > email to [email protected] <javascript:>. 
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> > For more options, visit https://groups.google.com/d/optout. 
>
>
>
> -- 
> Christoph Junghans 
> Web: http://www.compphys.de 
>

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==> Ran patch() for votca-tools
==> Building votca-tools [CMakePackage]
==> Executing phase : 'cmake'
==> Executing phase : 'build'
==> Error: ProcessError: Command exited with status 2:
    'make' '-j28'
/home/xiong/votca_spack/spack/lib/spack/spack/build_systems/cmake.py:154, in 
build:
     151      def build(self, spec, prefix):
     152          """Make the build targets"""
     153          with working_dir(self.build_directory):
  >> 154              inspect.getmodule(self).make(*self.build_targets)

See build log for details:
  /tmp/xiong/spack-stage/spack-stage-b635PZ/votca-tools-f507f69/spack-build.out

Attachment: spack-build.out
Description: Binary data

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