# ChangeLog for app-sci/ghemical
# Copyright 2002 Gentoo Technologies, Inc.; Distributed under the GPL v2
-# $Header: /var/cvsroot/gentoo-x86/app-sci/ghemical/ChangeLog,v 1.1 2002/10/29 02:20:12 hannes Exp $
+# $Header: /var/cvsroot/gentoo-x86/app-sci/ghemical/ChangeLog,v 1.2 2002/10/31 19:38:37 hannes Exp $
+
+ 31 Oct 2002; Hannes Mehnert <hannes@gentoo.org> ghemical-0.90.ebuild:
+ added --enable-mpqc (since mpqc is now in portage)
*ghemical-0.90.ebuild (28 Oct 2002)
# Copyright 1999-2002 Gentoo Technologies, Inc.
# Distributed under the terms of the GNU General Public License, v2 or later
-# $Header: /var/cvsroot/gentoo-x86/app-sci/ghemical/ghemical-0.90.ebuild,v 1.1 2002/10/29 02:20:13 hannes Exp $
+# $Header: /var/cvsroot/gentoo-x86/app-sci/ghemical/ghemical-0.90.ebuild,v 1.2 2002/10/31 19:38:37 hannes Exp $
DEPEND="gnome-base/gnome-libs
- dev-libs/libf2c"
-# app-sci/mpqc"
+ dev-libs/libf2c
+ app-sci/mpqc"
IUSE=""
SLOT="0"
-LICENSE="GPL"
+LICENSE="GPL-2"
KEYWORDS="~x86"
DESCRIPTION="Ghemical supports both quantum-mechanics (semi-empirical and ab initio) models and molecular mechanics models (there is an experimental Tripos 5.2-like force field for organic molecules). Also a tool for reduced protein models is included. Geometry optimization, molecular dynamics and a large set of visualization tools are currently available."
src_compile() {
patch -p0 < ${FILESDIR}/${P}-gentoo.patch
- ./configure --prefix=/usr #--enable-mpqc
+ ./configure --prefix=/usr --enable-mpqc
emake
}