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authorDonnie Berkholz <donnie@comet.(none)>2006-05-12 22:28:21 -0700
committerDonnie Berkholz <donnie@comet.(none)>2006-05-12 22:28:21 -0700
commite3c8d1d79ce41b2ec4b258f1a3ec0c847c356e1f (patch)
tree261e3592f7c025fbc5692039750b43d1e66fa67f /sci-libs
parentMerge branch 'master' of git+ssh://spyderous@people.freedesktop.org/~spyderou... (diff)
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Bump openbabel and ghemical to 2.0.x versions (#114260, #132835).
Diffstat (limited to 'sci-libs')
-rw-r--r--sci-libs/libghemical/ChangeLog25
-rw-r--r--sci-libs/libghemical/Manifest13
-rw-r--r--sci-libs/libghemical/files/digest-libghemical-1.901
-rw-r--r--sci-libs/libghemical/files/digest-libghemical-1.911
-rw-r--r--sci-libs/libghemical/files/digest-libghemical-2.003
-rw-r--r--sci-libs/libghemical/libghemical-2.00.ebuild (renamed from sci-libs/libghemical/libghemical-1.91.ebuild)34
-rw-r--r--sci-libs/libghemical/metadata.xml5
7 files changed, 24 insertions, 58 deletions
diff --git a/sci-libs/libghemical/ChangeLog b/sci-libs/libghemical/ChangeLog
deleted file mode 100644
index 7609687..0000000
--- a/sci-libs/libghemical/ChangeLog
+++ /dev/null
@@ -1,25 +0,0 @@
-# ChangeLog for sci-libs/libghemical
-# Copyright 1999-2005 Gentoo Foundation; Distributed under the GPL v2
-# $Header: /var/cvsroot/gentoo-x86/sci-libs/libghemical/ChangeLog,v 1.3 2005/12/06 11:03:18 spyderous Exp $
-
-*libghemical-1.91 (06 Dec 2005)
-
- 06 Dec 2005; Donnie Berkholz <spyderous@gentoo.org>;
- +libghemical-1.91.ebuild:
- Bump. Remove faulty libf2c dep; block on mpqc-2.3, pending upstream bug
- #237; Change openbabel dep to =1*, pending upstream bug #238; Add needed
- deps on virtual/blas and virtual/lapack.
-
- 02 Dec 2005; Donnie Berkholz <spyderous@gentoo.org>; +metadata.xml,
- +libghemical-1.90.ebuild:
- Move from sci-chemistry.
-
- 09 Jul 2005; David Holm <dholm@gentoo.org> libghemical-1.90.ebuild:
- Added to ~ppc.
-
-*libghemical-1.90 (09 Jul 2005)
-
- 09 Jul 2005; Donnie Berkholz <spyderous@gentoo.org>; +metadata.xml,
- +libghemical-1.90.ebuild:
- Initial commit of development version.
-
diff --git a/sci-libs/libghemical/Manifest b/sci-libs/libghemical/Manifest
index b8a066c..4a3ec19 100644
--- a/sci-libs/libghemical/Manifest
+++ b/sci-libs/libghemical/Manifest
@@ -1,5 +1,8 @@
-MD5 d82c65a79763b8fb8cd9c1663ab4a711 ChangeLog 912
-MD5 9e76c51c466b9b689c090d08b7d371dc files/digest-libghemical-1.90 65
-MD5 24cb392d27e0cac4b58dffc8840593b2 files/digest-libghemical-1.91 66
-MD5 c52950154e821df024fb6ceae543bbd3 libghemical-1.91.ebuild 1298
-MD5 8c623e53daafa025137077c6b65815bd metadata.xml 156
+DIST libghemical-2.00.tar.gz 629479 RMD160 8c49ce3f128ef937dfb4443e4ffebff0b9183a1d SHA1 3be7f292752657b3a49b8417e2d43dc262ecd45b SHA256 e873b3042df75fa1c9f37fc99f2ff14227965ed13c7680169f714ab6575d5f21 size 629479
+EBUILD libghemical-2.00.ebuild 1147 RMD160 1c867427683398042b1483dcbac8aa636d5d8711 SHA1 b7ee180bfebce58c1d8efbfffff82f16dcb2e474 SHA256 9cb3a270b763cda43cd19adadb813d1b55757e95279c33cb3ccd168c3fe5cb47 size 1147
+MD5 90793f1e95902a4aecd50db1a58d04e3 libghemical-2.00.ebuild 1147
+RMD160 1c867427683398042b1483dcbac8aa636d5d8711 libghemical-2.00.ebuild 1147
+SHA256 9cb3a270b763cda43cd19adadb813d1b55757e95279c33cb3ccd168c3fe5cb47 libghemical-2.00.ebuild 1147
+MD5 7f87b48888976c4f8a36e51086d510d0 files/digest-libghemical-2.00 250
+RMD160 99e1628f557e0a02ffe74cb785c39b923bd5ac79 files/digest-libghemical-2.00 250
+SHA256 7008fb2104b8b7d02bdc3ff751ec150f920aa8d35e4784a7345d61a9456d5379 files/digest-libghemical-2.00 250
diff --git a/sci-libs/libghemical/files/digest-libghemical-1.90 b/sci-libs/libghemical/files/digest-libghemical-1.90
deleted file mode 100644
index 05064c7..0000000
--- a/sci-libs/libghemical/files/digest-libghemical-1.90
+++ /dev/null
@@ -1 +0,0 @@
-MD5 074e485c4786342ba045b616eee0c2da libghemical-1.90.tgz 636435
diff --git a/sci-libs/libghemical/files/digest-libghemical-1.91 b/sci-libs/libghemical/files/digest-libghemical-1.91
deleted file mode 100644
index 39035a6..0000000
--- a/sci-libs/libghemical/files/digest-libghemical-1.91
+++ /dev/null
@@ -1 +0,0 @@
-MD5 6832615a8411c46c6f1b011a7354106e libghemical-1.91.tgz 1087881
diff --git a/sci-libs/libghemical/files/digest-libghemical-2.00 b/sci-libs/libghemical/files/digest-libghemical-2.00
new file mode 100644
index 0000000..ae7c83b
--- /dev/null
+++ b/sci-libs/libghemical/files/digest-libghemical-2.00
@@ -0,0 +1,3 @@
+MD5 19ee087b6f3c0ce816ed1722b4a5b002 libghemical-2.00.tar.gz 629479
+RMD160 8c49ce3f128ef937dfb4443e4ffebff0b9183a1d libghemical-2.00.tar.gz 629479
+SHA256 e873b3042df75fa1c9f37fc99f2ff14227965ed13c7680169f714ab6575d5f21 libghemical-2.00.tar.gz 629479
diff --git a/sci-libs/libghemical/libghemical-1.91.ebuild b/sci-libs/libghemical/libghemical-2.00.ebuild
index 4334db2..e81ef0b 100644
--- a/sci-libs/libghemical/libghemical-1.91.ebuild
+++ b/sci-libs/libghemical/libghemical-2.00.ebuild
@@ -1,39 +1,31 @@
-# Copyright 1999-2005 Gentoo Foundation
+# Copyright 1999-2006 Gentoo Foundation
# Distributed under the terms of the GNU General Public License v2
-# $Header: /var/cvsroot/gentoo-x86/sci-libs/libghemical/libghemical-1.91.ebuild,v 1.1 2005/12/06 11:03:18 spyderous Exp $
+# $Header: /var/cvsroot/gentoo-x86/sci-libs/libghemical/libghemical-1.91.ebuild,v 1.2 2006/01/18 11:08:58 spyderous Exp $
inherit eutils
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."
-HOMEPAGE="http://www.uku.fi/~thassine/ghemical/"
-SRC_URI="http://www.uku.fi/~thassine/ghemical/download/${P}.tgz"
-
+HOMEPAGE="http://bioinformatics.org/ghemical/"
+SRC_URI="http://www.bioinformatics.org/ghemical/download/${P}.tar.gz"
LICENSE="GPL-2"
SLOT="0"
KEYWORDS="~ppc ~x86"
-IUSE="mopac7 mpqc openbabel"
-
-RDEPEND="virtual/glut
- mopac7? ( sci-chemistry/mopac7 )
- openbabel? ( =sci-chemistry/openbabel-1.100.2 )
- mpqc? ( <sci-chemistry/mpqc-2.3.0 )
- virtual/blas
- virtual/lapack"
-
+IUSE="mopac7 mpqc"
+RDEPEND="mopac7? ( sci-chemistry/mopac7 )
+ mpqc? ( sci-chemistry/mpqc
+ virtual/blas
+ virtual/lapack )"
DEPEND="${RDEPEND}
>=dev-util/pkgconfig-0.15"
src_compile() {
- libtoolize --copy --force
-
- ./configure \
- --prefix=/usr \
+ econf \
$(use_enable mopac7) \
$(use_enable mpqc) \
- $(use_enable openbabel) || die "Configure failed"
- emake || die "Make failed"
+ || die "configure failed"
+ emake || die "make failed"
}
src_install() {
- make DESTDIR="${D}" install || die "Install failed"
+ make DESTDIR="${D}" install || die "install failed"
}
diff --git a/sci-libs/libghemical/metadata.xml b/sci-libs/libghemical/metadata.xml
deleted file mode 100644
index b229aec..0000000
--- a/sci-libs/libghemical/metadata.xml
+++ /dev/null
@@ -1,5 +0,0 @@
-<?xml version="1.0" encoding="UTF-8"?>
-<!DOCTYPE pkgmetadata SYSTEM "http://www.gentoo.org/dtd/metadata.dtd">
-<pkgmetadata>
-<herd>sci</herd>
-</pkgmetadata>