[ghemical-devel] support for MPQC v2 was added

[Tommi Hassinen]

On Mon, 20 May 2002, Michael Banck wrote:

> On Mon, May 20, 2002 at 04:11:07PM +0300, Tommi Hassinen wrote:
> > Could you still send me an another patch with all these changes?
>  
> attached. Hopefully I didn't miss anything. I didn't include the changes
> autoconf did to configure in order to keep the diff small.

Thanks!

It looks quite good, but now I have some problems with autoconf here.
Is it so that one should use autoconf just by running

	autoconf

at the source top directory, right? It updated the configure script, and
the script worked OK otherwise except that in the resulting Makefile the
top_builddir variable was not set:

	top_builddir=

so the Makefile didn't work. I fixed that manually:

	top_builddir=	/home/thassine/ghemical

and then everything worked in the simple "./configure" case. Then I tried
"./configure --enable-mpqc" and it went a bit worse. It gives

$ make
g++  -c -g -O2 -fno-exceptions -I../../src/graphics -I../../src/common
-I../../openbabel -I../..//src -I/usr/include/gtk-1.2
-I/usr/include/glib-1.2 -I/usr/lib/glib/include -I/usr/X11R6/include
-I/usr/include/gnome-1.0 -DNEED_GNOMESUPPORT_H
-I/usr/lib/gnome-libs/include -I/usr/include/gtk-1.2
-I/usr/include/glib-1.2 -I/usr/lib/glib/include -I/usr/X11R6/include
./qm1docv.cpp
In file included from ./qm1docv.cpp:14:
../../src/common/qm1e_mpqc.h:27: util/keyval/keyval.h: No such file or
directory

so, under src/graphics, the MPQC cflags are not passed to g++ command
line.

Did I do something wrong with the autoconf, or is it a wrong version or
something like that?

	Tommi