Mercurial > repos > bgruening > silicos_it
view tool_dependencies.xml @ 16:4fe6069549ef
ChemicalToolBoX update.
author | Bjoern Gruening <bjoern.gruening@gmail.com> |
---|---|
date | Wed, 29 May 2013 20:24:02 +0200 |
parents | 172caea2920d |
children | 62897185a803 |
line wrap: on
line source
<?xml version='1.0' encoding='utf-8'?> <tool_dependency> <package name="numpy" version="1.7.1"> <repository changeset_revision="ad6ebe2c75ef" name="package_numpy_1_7" owner="bgruening" prior_installation_required="True" toolshed="http://testtoolshed.g2.bx.psu.edu/" /> </package> <package name="openbabel" version="2.3.2"> <repository changeset_revision="3a993ff17df5" name="package_openbabel_2_3" owner="bgruening" prior_installation_required="True" toolshed="http://testtoolshed.g2.bx.psu.edu/" /> </package> <package name="rdkit" version="2012_12_1"> <repository changeset_revision="8df0530b1c1c" name="package_rdkit_2012_12" owner="bgruening" prior_installation_required="True" toolshed="http://testtoolshed.g2.bx.psu.edu/" /> </package> <package name="silicos_it" version="1.0.0"> <install version="1.0"> <actions> <action type="download_by_url">http://www.silicos-it.com/_php/download.php?file=strip-it-1.0.1.tar.gz</action> <action type="set_environment_for_install"> <repository changeset_revision="3a993ff17df5" name="package_openbabel_2_3" owner="bgruening" toolshed="http://testtoolshed.g2.bx.psu.edu/"> <package name="openbabel" version="2.3.2" /> </repository> </action> <action type="shell_command"> cd strip-it-1.0.1 && cmake . -DOPENBABEL2_INCLUDE_DIRS=$OPENBABEL_INCLUDE_DIR/openbabel-2.0/ -DCMAKE_INSTALL_PREFIX=$INSTALL_DIR/strip-it/ -DOPENBABEL2_LIBRARIES=$OPENBABEL_LIB_DIR/libopenbabel.so && make && make install</action> <action type="set_environment"> <environment_variable action="prepend_to" name="PATH">$INSTALL_DIR/strip-it/bin</environment_variable> </action> <action type="shell_command">wget http://www.silicos-it.com/_php/download.php?file=align-it-1.0.3.tar.gz</action> <action type="shell_command">tar xfvz download.php?file=align-it-1.0.3.tar.gz && cd align-it-1.0.3 && cmake . -DOPENBABEL2_INCLUDE_DIRS=$OPENBABEL_INCLUDE_DIR/openbabel-2.0/ -DCMAKE_INSTALL_PREFIX=$INSTALL_DIR/align-it/ -DOPENBABEL2_LIBRARIES=$OPENBABEL_LIB_DIR/libopenbabel.so && make && make install</action> <action type="set_environment"> <environment_variable action="prepend_to" name="PATH">$INSTALL_DIR/align-it/bin</environment_variable> </action> <action type="shell_command">wget http://www.silicos-it.com/_php/download.php?file=shape-it-1.0.1.tar.gz</action> <action type="shell_command">tar xfvz download.php?file=shape-it-1.0.1.tar.gz && cd shape-it-1.0.1 && cmake . -DOPENBABEL2_INCLUDE_DIRS=$OPENBABEL_INCLUDE_DIR/openbabel-2.0/ -DCMAKE_INSTALL_PREFIX=$INSTALL_DIR/shape-it/ -DOPENBABEL2_LIBRARIES=$OPENBABEL_LIB_DIR/libopenbabel.so && make && make install</action> <action type="set_environment"> <environment_variable action="prepend_to" name="PATH">$INSTALL_DIR/shape-it/bin</environment_variable> </action> </actions> </install> <readme>Compiling silicos-it requires g++ and CMake 2.4+.</readme> </package> </tool_dependency>