How to install IQmol in Linux?
The IQmol is widely used to analyze the ouptut files form Q-Chem electronic structure theory code. In Windows, it is straight forward to install IQmol.exe package and it works fine.
However, in Linux distribution (Ubuntu 16.04), the .deb package can be installed just by downloading and opening in package installer. However, some functionalities are missing in installation.
Installation from the source.
I cloned the source code from GitHub.com/Iqmol and tried ./configure. I got following error.
./configure
The output in the terminal is:
-- The C compiler identification is GNU 5.4.0
-- The CXX compiler identification is GNU 5.4.0
-- The Fortran compiler identification is GNU 5.4.0
-- Check for working C compiler: /usr/bin/cc
-- Check for working C compiler: /usr/bin/cc -- works
-- Detecting C compiler ABI info
-- Detecting C compiler ABI info - done
-- Detecting C compile features
-- Detecting C compile features - done
-- Check for working CXX compiler: /usr/bin/c++
-- Check for working CXX compiler: /usr/bin/c++ -- works
-- Detecting CXX compiler ABI info
-- Detecting CXX compiler ABI info - done
-- Detecting CXX compile features
-- Detecting CXX compile features - done
-- Check for working Fortran compiler: /usr/bin/gfortran
-- Check for working Fortran compiler: /usr/bin/gfortran -- works
-- Detecting Fortran compiler ABI info
-- Detecting Fortran compiler ABI info - done
-- Checking whether /usr/bin/gfortran supports Fortran 90
-- Checking whether /usr/bin/gfortran supports Fortran 90 -- yes
-- Found OpenGL: /usr/lib/x86_64-linux-gnu/libGL.so
CMake Error at /usr/lib/x86_64-linux-gnu/cmake/Qt5/Qt5Config.cmake:26 (find_package):
Could not find a package configuration file provided by "Qt5QtCore" with
any of the following names:
Qt5QtCoreConfig.cmake
qt5qtcore-config.cmake
Add the installation prefix of "Qt5QtCore" to CMAKE_PREFIX_PATH or set
"Qt5QtCore_DIR" to a directory containing one of the above files. If
"Qt5QtCore" provides a separate development package or SDK, be sure it has
been installed.
Call Stack (most recent call first):
CMakeLists.txt:5 (find_package)
-- Configuring incomplete, errors occurred!
See also "/home/full/path/to/IMol/build/CMakeFiles/CMakeOutput.log".
The IQmol is widely used to analyze the ouptut files form Q-Chem electronic structure theory code. In Windows, it is straight forward to install IQmol.exe package and it works fine.
However, in Linux distribution (Ubuntu 16.04), the .deb package can be installed just by downloading and opening in package installer. However, some functionalities are missing in installation.
Installation from the source.
I cloned the source code from GitHub.com/Iqmol and tried ./configure. I got following error.
./configure
The output in the terminal is:
-- The C compiler identification is GNU 5.4.0
-- The CXX compiler identification is GNU 5.4.0
-- The Fortran compiler identification is GNU 5.4.0
-- Check for working C compiler: /usr/bin/cc
-- Check for working C compiler: /usr/bin/cc -- works
-- Detecting C compiler ABI info
-- Detecting C compiler ABI info - done
-- Detecting C compile features
-- Detecting C compile features - done
-- Check for working CXX compiler: /usr/bin/c++
-- Check for working CXX compiler: /usr/bin/c++ -- works
-- Detecting CXX compiler ABI info
-- Detecting CXX compiler ABI info - done
-- Detecting CXX compile features
-- Detecting CXX compile features - done
-- Check for working Fortran compiler: /usr/bin/gfortran
-- Check for working Fortran compiler: /usr/bin/gfortran -- works
-- Detecting Fortran compiler ABI info
-- Detecting Fortran compiler ABI info - done
-- Checking whether /usr/bin/gfortran supports Fortran 90
-- Checking whether /usr/bin/gfortran supports Fortran 90 -- yes
-- Found OpenGL: /usr/lib/x86_64-linux-gnu/libGL.so
CMake Error at /usr/lib/x86_64-linux-gnu/cmake/Qt5/Qt5Config.cmake:26 (find_package):
Could not find a package configuration file provided by "Qt5QtCore" with
any of the following names:
Qt5QtCoreConfig.cmake
qt5qtcore-config.cmake
Add the installation prefix of "Qt5QtCore" to CMAKE_PREFIX_PATH or set
"Qt5QtCore_DIR" to a directory containing one of the above files. If
"Qt5QtCore" provides a separate development package or SDK, be sure it has
been installed.
Call Stack (most recent call first):
CMakeLists.txt:5 (find_package)
-- Configuring incomplete, errors occurred!
See also "/home/full/path/to/IMol/build/CMakeFiles/CMakeOutput.log".
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