[ghemical-devel] ghemical-2.98 released

[Radek Liboska PhD.]

 > Hello,
 > >
 > > today I released the following stuff:
 > >
 > > ghemical-2.98.tar.gz
 > > libghemical-2.98.tar.gz
 > > liboglappth-0.98.tar.gz
 > >
 > > in the usual places ; you can get them for example here:
 > > http://www.uku.fi/~thassine/projects/download/release20080731/


Firstly, I have to add -lf2c to ghemical's Makefile

Secondly I've got this error when building ghemical:

...
make[3]: Entering directory `/home/liboska/ghemical-2.98/src'
/bin/sh ../libtool --mode=link g++  -g -O2   -o ghemical  fileio.o filetrans.o 
custom_app.o custom_camera.o custom_lights.o project.o spline.o 
pangofont_wcl.o oglview_wcl.o ac_stor_wcl.o p1dview_wcl.o p2dview_wcl.o 
eldview_wcl.o rcpview_wcl.o gpcview_wcl.o ogl_plane.o ogl_surface.o 
ogl_ribbon.o gtk_simple_dialogs.o gtk_glade_dialog.o gtk_file_export_dialog.o 
gtk_file_import_dialog.o gtk_geomopt_dialog.o gtk_moldyn_dialog.o 
gtk_progress_dialog.o gtk_setup_dialog.o gtk_stereo_dialog.o 
gtk_trajview_dialog.o gtk_wnd.o gtk_oglview_wnd.o gtk_p1dview_wnd.o 
gtk_p2dview_wnd.o gtk_eldview_wnd.o gtk_rcpview_wnd.o gtk_gpcview_wnd.o 
gtk_app.o gtk_project.o gtk_main.o  -lm  -L/usr/X11R6/lib -pthread 
-lgthread-2.0 -lrt -lglib-2.0 -lf2c  -lgtk-x11-2.0 -lgdk-x11-2.0 -latk-1.0 
-lgdk_pixbuf-2.0 -lpangocairo-1.0 -lpango-1.0 -lcairo -lgobject-2.0 
-lgmodule-2.0 -ldl -lglib-2.0   -Wl,--export-dynamic -lgtkglext-x11-1.0 
-lgdkglext-x11-1.0 -lGLU -lGL -lXmu -lXt -lSM -lICE -lgtk-x11-2.0 -lpangox-1.0 
-lgdk-x11-2.0 -latk-1.0 -lgdk_pixbuf-2.0 -lpangocairo-1.0 -lpango-1.0 -lcairo 
-lgobject-2.0 -lgmodule-2.0 -ldl -lglib-2.0   -lglade-2.0 -lgtk-x11-2.0 -lxml2 
-lgdk-x11-2.0 -latk-1.0 -lgdk_pixbuf-2.0 -lpangocairo-1.0 -lpango-1.0 -lcairo 
-lgobject-2.0 -lgmodule-2.0 -ldl -lglib-2.0   -lopenbabel 
-L/usr/lib/gcc/i386-redhat-linux/4.1.2 
-L/usr/lib/gcc/i386-redhat-linux/4.1.2/../../.. -lghemical -lSCoptions -lSCpsi 
-lSCmbpt -lSCdft -lSCscf -lSCwfn -lSCsolvent -lSCintv3 -lSCbasis -lSCoint3 
-lSCmolecule -lSCsymmetry -lSCisosurf -lSCoptimize -lSCscmat -lSCgroup 
-lSCrender -lSCmisc -lSCstate -lSCkeyval -lSCclass -lSCcontainer -lSCref -lfl 
-ldl -lpthread -llapack -lblas -lgfortranbegin -lgfortran -lm -lgcc_s -lmopac7 
   -loglappth
g++ -g -O2 -o ghemical fileio.o filetrans.o custom_app.o custom_camera.o 
custom_lights.o project.o spline.o pangofont_wcl.o oglview_wcl.o ac_stor_wcl.o 
p1dview_wcl.o p2dview_wcl.o eldview_wcl.o rcpview_wcl.o gpcview_wcl.o 
ogl_plane.o ogl_surface.o ogl_ribbon.o gtk_simple_dialogs.o gtk_glade_dialog.o 
gtk_file_export_dialog.o gtk_file_import_dialog.o gtk_geomopt_dialog.o 
gtk_moldyn_dialog.o gtk_progress_dialog.o gtk_setup_dialog.o 
gtk_stereo_dialog.o gtk_trajview_dialog.o gtk_wnd.o gtk_oglview_wnd.o 
gtk_p1dview_wnd.o gtk_p2dview_wnd.o gtk_eldview_wnd.o gtk_rcpview_wnd.o 
gtk_gpcview_wnd.o gtk_app.o gtk_project.o gtk_main.o -pthread 
-Wl,--export-dynamic  -L/usr/X11R6/lib -lgthread-2.0 -lrt -lf2c 
-lgtkglext-x11-1.0 -lgdkglext-x11-1.0 -lGLU -lGL -lXmu -lXt -lSM -lICE 
-lpangox-1.0 -lglade-2.0 -lgtk-x11-2.0 -lxml2 -lgdk-x11-2.0 -latk-1.0 
-lgdk_pixbuf-2.0 -lpangocairo-1.0 -lpango-1.0 -lcairo -lgobject-2.0 
-lgmodule-2.0 -lglib-2.0 -lopenbabel -L/usr/lib/gcc/i386-redhat-linux/4.1.2 
-L/usr/lib/gcc/i386-redhat-linux/4.1.2/../../.. /usr/lib/libghemical.so 
/usr/lib/libSCoptions.so /usr/lib/libSCpsi.so /usr/lib/libSCmbpt.so 
/usr/lib/libSCdft.so /usr/lib/libSCscf.so /usr/lib/libSCwfn.so 
/usr/lib/libSCsolvent.so /usr/lib/libSCintv3.so /usr/lib/libSCbasis.so 
/usr/lib/libSCoint3.so /usr/lib/libSCmolecule.so /usr/lib/libSCsymmetry.so 
/usr/lib/libSCisosurf.so /usr/lib/libSCoptimize.so /usr/lib/libSCscmat.so 
/usr/lib/libSCgroup.so /usr/lib/libSCrender.so /usr/lib/libSCmisc.so 
/usr/lib/libSCstate.so /usr/lib/libSCkeyval.so /usr/lib/libSCclass.so 
/usr/lib/libSCcontainer.so /usr/lib/libSCref.so -lfl -ldl -lpthread -llapack 
-lblas -lgfortranbegin -lgfortran -lm -lgcc_s /usr/lib/libmopac7.so 
/usr/lib/liboglappth.so
project.o: In function `project::AddAtom_lg(atom&)':
/home/liboska/ghemical-2.98/src/project.cpp:437: undefined reference to 
`model::AddAtom_lg(atom&)'
project.o: In function `project::DoEnergyPlot2D(int, int, int, int, int, 
float, float, int, int, int, int, int, float, float, int)':
/home/liboska/ghemical-2.98/src/project.cpp:3730: undefined reference to 
`setup1_sf::setup1_sf(model*, setup1_sf::SFmode, bool)'
project.o: In function `project::DoEnergyPlot1D(int, int, int, int, int, 
float, float, int)':
/home/liboska/ghemical-2.98/src/project.cpp:3549: undefined reference to 
`setup1_sf::setup1_sf(model*, setup1_sf::SFmode, bool)'
project.o:(.rodata._ZTV13dummy_project[vtable for dummy_project]+0x80): 
undefined reference to `model::NoThreadsIterate()'
project.o:(.rodata._ZTV7project[vtable for project]+0x80): undefined reference 
to `model::NoThreadsIterate()'
gtk_setup_dialog.o: In function 
`gtk_setup_dialog::handler_ButtonOK(_GtkWidget*, void*)':
/home/liboska/ghemical-2.98/src/gtk_setup_dialog.cpp:318: undefined reference 
to `setup1_sf::setup1_sf(model*, setup1_sf::SFmode, bool)'
gtk_project.o:(.rodata._ZTV11gtk_project[vtable for gtk_project]+0x9c): 
undefined reference to `model::NoThreadsIterate()'
gtk_main.o: In function `main':
/home/liboska/ghemical-2.98/src/gtk_main.cpp:79: undefined reference to 
`libghemical_init(char const*)'
collect2: ld returned 1 exit status
make[3]: *** [ghemical] Error 1
make[3]: Leaving directory `/home/liboska/ghemical-2.98/src'
make[2]: *** [all-recursive] Error 1
make[2]: Leaving directory `/home/liboska/ghemical-2.98/src'
make[1]: *** [all] Error 2
make[1]: Leaving directory `/home/liboska/ghemical-2.98/src'
make: *** [all-recursive] Error 1






-- 
                  Radek Liboska, PhD.
Institute of Organic Chemistry and Biochemistry
Flemingovo n. 2, Praha 6, 166 10, Czech Republic
++420-220183-387