2011-01-24から1日間の記事一覧

Xtalopt

git clone git://github.com/dlonie/XtalOpt.git xtaloptexport Avogadro_DIR=$HOME/lib/avogadrocmake .. -DOPENBABEL2_INCLUDE_DIR=$HOME/include/openbabel-2.0 -DOPENBABEL2_LIBRARIES=$HOME/lib/libopenbabel.so \ -DOPENBABEL2_VERSION_MET=true -DOPE…

Avogadro from git dlonie

Requirement git, cmake, eigen2, openbabel, qt4 (libqt4-dev?), pyqt4 (pyqt4-dev-tools?), sip (sip4?), boost (libboost-dev?), glew (libglew-dev). Install Following instruction found here, http://xtalopt.openmolecules.net/wiki/index.fcgi/wiki…

Open Babel from svn

Requirement cmakeInstall following the section 'Installing locally without root access'. -DCMAKE_INSTALL_PREFIX has to be set for local installation.Set LD_LIBRARY_PATH to openbabel/lib directory.