[arch-commits] Commit in openbabel/trunk (PKGBUILD)

2020-11-12 Thread Evangelos Foutras via arch-commits
Date: Thursday, November 12, 2020 @ 19:54:38
  Author: foutrelis
Revision: 400716

upgpkg: openbabel 3.1.1-2: Python 3.9 rebuild

Modified:
  openbabel/trunk/PKGBUILD

--+
 PKGBUILD |2 +-
 1 file changed, 1 insertion(+), 1 deletion(-)

Modified: PKGBUILD
===
--- PKGBUILD2020-11-12 19:53:38 UTC (rev 400715)
+++ PKGBUILD2020-11-12 19:54:38 UTC (rev 400716)
@@ -5,7 +5,7 @@
 pkgbase=openbabel
 pkgname=(openbabel python-openbabel)
 pkgver=3.1.1
-pkgrel=1
+pkgrel=2
 pkgdesc="A library designed to interconvert between many file formats used in 
molecular modeling and computational chemistry"
 arch=('x86_64')
 url="https://openbabel.org/wiki/Main_Page;


[arch-commits] Commit in openbabel/trunk (PKGBUILD)

2020-05-08 Thread Antonio Rojas via arch-commits
Date: Friday, May 8, 2020 @ 17:49:57
  Author: arojas
Revision: 382804

Update to 3.1.1

Modified:
  openbabel/trunk/PKGBUILD

--+
 PKGBUILD |6 +++---
 1 file changed, 3 insertions(+), 3 deletions(-)

Modified: PKGBUILD
===
--- PKGBUILD2020-05-08 16:56:38 UTC (rev 382803)
+++ PKGBUILD2020-05-08 17:49:57 UTC (rev 382804)
@@ -4,8 +4,8 @@
 
 pkgbase=openbabel
 pkgname=(openbabel python-openbabel)
-pkgver=3.1.0
-pkgrel=2
+pkgver=3.1.1
+pkgrel=1
 pkgdesc="A library designed to interconvert between many file formats used in 
molecular modeling and computational chemistry"
 arch=('x86_64')
 url="https://openbabel.org/wiki/Main_Page;
@@ -12,7 +12,7 @@
 license=('GPL')
 makedepends=('cmake' 'eigen' 'wxgtk3' 'boost' 'python' 'swig' 'maeparser' 
'rapidjson' 'coordgen')
 
source=("https://github.com/openbabel/openbabel/releases/download/openbabel-${pkgver//./-}/openbabel-$pkgver-source.tar.bz2;)
-sha256sums=('53ff96d53a190097d9a0d5243be2b7c97a6a844129a303e93cbe6e3aaf1723f9')
+sha256sums=('a6ec8381d59ea32a4b241c8b1fbd799acb52be94ab64cdbd72506fb4e2270e68')
 
 prepare() {
   mkdir -p build


[arch-commits] Commit in openbabel/trunk (PKGBUILD)

2020-05-06 Thread Antonio Rojas via arch-commits
Date: Wednesday, May 6, 2020 @ 10:20:07
  Author: arojas
Revision: 382377

Depend on coordgen since the cmake config depends on it

Modified:
  openbabel/trunk/PKGBUILD

--+
 PKGBUILD |6 +++---
 1 file changed, 3 insertions(+), 3 deletions(-)

Modified: PKGBUILD
===
--- PKGBUILD2020-05-06 09:40:07 UTC (rev 382376)
+++ PKGBUILD2020-05-06 10:20:07 UTC (rev 382377)
@@ -5,7 +5,7 @@
 pkgbase=openbabel
 pkgname=(openbabel python-openbabel)
 pkgver=3.1.0
-pkgrel=1
+pkgrel=2
 pkgdesc="A library designed to interconvert between many file formats used in 
molecular modeling and computational chemistry"
 arch=('x86_64')
 url="https://openbabel.org/wiki/Main_Page;
@@ -32,8 +32,8 @@
 }
 
 package_openbabel() {
-  depends=('libxml2' 'libsm')
-  optdepends=('wxgtk3: GUI interface' 'maeparser: maestro format support')
+  depends=('libxml2' 'libsm' 'coordgen')
+  optdepends=('wxgtk3: GUI interface')
 
   cd build
   make DESTDIR="$pkgdir" install


[arch-commits] Commit in openbabel/trunk (PKGBUILD system-maeparser.patch)

2020-05-06 Thread Antonio Rojas via arch-commits
Date: Wednesday, May 6, 2020 @ 08:06:23
  Author: arojas
Revision: 382371

Update to 3.1.0

Modified:
  openbabel/trunk/PKGBUILD
Deleted:
  openbabel/trunk/system-maeparser.patch

+
 PKGBUILD   |   17 +-
 system-maeparser.patch |  280 ---
 2 files changed, 6 insertions(+), 291 deletions(-)

Modified: PKGBUILD
===
--- PKGBUILD2020-05-06 07:50:19 UTC (rev 382370)
+++ PKGBUILD2020-05-06 08:06:23 UTC (rev 382371)
@@ -1,26 +1,21 @@
-# Maintainer:
+# Maintainer: Antonio Rojas 
 # Contributor: Andrea Scarpino 
 # Contributor: Damir Perisa 
 
 pkgbase=openbabel
 pkgname=(openbabel python-openbabel)
-pkgver=3.0.0
-pkgrel=3
+pkgver=3.1.0
+pkgrel=1
 pkgdesc="A library designed to interconvert between many file formats used in 
molecular modeling and computational chemistry"
 arch=('x86_64')
 url="https://openbabel.org/wiki/Main_Page;
 license=('GPL')
-makedepends=('cmake' 'eigen' 'wxgtk3' 'boost' 'python' 'swig' 'maeparser' 
'rapidjson')
-source=("https://github.com/openbabel/openbabel/releases/download/openbabel-${pkgver//./-}/openbabel-$pkgver-source.tar.bz2;
-
system-maeparser.patch::"https://github.com/openbabel/openbabel/commit/8500f8a9.patch;)
-sha256sums=('aad58ef8deaea9f58faeecb333f87bb18e0bdf4854e3a3b188a814a8c4517259'
-'14d2b019dfb3e4d6d1b8a529e5da8c2ec84b1e599b9ae74913f8548542d0ab4b')
+makedepends=('cmake' 'eigen' 'wxgtk3' 'boost' 'python' 'swig' 'maeparser' 
'rapidjson' 'coordgen')
+source=("https://github.com/openbabel/openbabel/releases/download/openbabel-${pkgver//./-}/openbabel-$pkgver-source.tar.bz2;)
+sha256sums=('53ff96d53a190097d9a0d5243be2b7c97a6a844129a303e93cbe6e3aaf1723f9')
 
 prepare() {
   mkdir -p build
-
-  cd $pkgbase-$pkgver
-  patch -p1 -i ../system-maeparser.patch # Unbundle maeparser
 }
 
 build() {

Deleted: system-maeparser.patch
===
--- system-maeparser.patch  2020-05-06 07:50:19 UTC (rev 382370)
+++ system-maeparser.patch  2020-05-06 08:06:23 UTC (rev 382371)
@@ -1,280 +0,0 @@
-From e259b6737787d2545f45b63c90f0f27a40e0179f Mon Sep 17 00:00:00 2001
-From: Ricardo R-S 
-Date: Wed, 16 Oct 2019 15:57:46 -0400
-Subject: [PATCH 1/7] add Find modules for maeparser and coordgen
-

- cmake/modules/Findcoordgen.cmake  | 46 +++
- cmake/modules/Findmaeparser.cmake | 32 +
- 2 files changed, 78 insertions(+)
- create mode 100644 cmake/modules/Findcoordgen.cmake
- create mode 100644 cmake/modules/Findmaeparser.cmake
-
-diff --git a/cmake/modules/Findmaeparser.cmake 
b/cmake/modules/Findmaeparser.cmake
-new file mode 100644
-index 0..920b3ec8e
 /dev/null
-+++ b/cmake/modules/Findmaeparser.cmake
-@@ -0,0 +1,32 @@
-+# Try to find Schrodinger's MAEParser libraries.
-+#
-+# Different version handling is not yet supported
-+#
-+# Once found, this will find and define the following variables:
-+#
-+# maeparser_INCLUDE_DIRS  - maeparser's includes directory
-+# maeparser_LIBRARIES - maeparser's shared libraries
-+#
-+#
-+
-+include(FindPackageHandleStandardArgs)
-+
-+find_path(maeparser_INCLUDE_DIRS
-+NAMES "maeparser/Reader.hpp"
-+HINTS ${maeparser_DIR}
-+PATH_SUFFIXES "include"
-+DOC "include path for maeparser"
-+)
-+message(STATUS "maeparser include dir set as '${maeparser_INCLUDE_DIRS}'")
-+
-+find_library(maeparser_LIBRARIES
-+NAMES maeparser
-+HINTS ${maeparser_DIR}
-+PATH_SUFFIXES "lib"
-+DOC "libraries for maeparser"
-+)
-+message(STATUS "maeparser libraries set as '${maeparser_LIBRARIES}'")
-+
-+find_package_handle_standard_args(maeparser FOUND_VAR maeparser_FOUND
-+  REQUIRED_VARS maeparser_INCLUDE_DIRS
-+  maeparser_LIBRARIES)
-
-From c4c6ef37d91c8b27e0b8af9f2e4772332caa7cf1 Mon Sep 17 00:00:00 2001
-From: Ricardo R-S 
-Date: Wed, 16 Oct 2019 15:59:18 -0400
-Subject: [PATCH 2/7] update CMakelists
-

- CMakeLists.txt | 124 ++---
- 1 file changed, 108 insertions(+), 16 deletions(-)
-
-diff --git a/CMakeLists.txt b/CMakeLists.txt
-index e8396dd17..26edc9433 100644
 a/CMakeLists.txt
-+++ b/CMakeLists.txt
-@@ -482,33 +482,65 @@ find_package(Boost)
- if(Boost_FOUND AND BUILD_SHARED)
- include_directories(${Boost_INCLUDE_DIRS} ${Boost_INCLUDE_DIR})
- option(WITH_MAEPARSER "Build Maestro support" ON)
- else()
- option(WITH_MAEPARSER "Build Maestro support" OFF)
- endif()
- 
--
- if(WITH_MAEPARSER)
--set (CMAKE_CXX_STANDARD 11)
--
--set(MAEPARSER_VERSION 1.1)
--if(NOT EXISTS 
"${openbabel_SOURCE_DIR}/external/maeparser-${MAEPARSER_VERSION}")
--file(DOWNLOAD 
"https://github.com/schrodinger/maeparser/archive/v${MAEPARSER_VERSION}.tar.gz;
--

[arch-commits] Commit in openbabel/trunk (PKGBUILD system-maeparser.patch)

2019-11-29 Thread Antonio Rojas via arch-commits
Date: Friday, November 29, 2019 @ 13:53:59
  Author: arojas
Revision: 369909

Use system maeparser, switch to gtk3

Added:
  openbabel/trunk/system-maeparser.patch
Modified:
  openbabel/trunk/PKGBUILD

+
 PKGBUILD   |   20 ++-
 system-maeparser.patch |  280 +++
 2 files changed, 293 insertions(+), 7 deletions(-)

Modified: PKGBUILD
===
--- PKGBUILD2019-11-29 13:37:49 UTC (rev 369908)
+++ PKGBUILD2019-11-29 13:53:59 UTC (rev 369909)
@@ -1,20 +1,26 @@
-# Maintainer: Andrea Scarpino 
+# Maintainer:
+# Contributor: Andrea Scarpino 
 # Contributor: Damir Perisa 
 
 pkgbase=openbabel
 pkgname=(openbabel python-openbabel)
 pkgver=3.0.0
-pkgrel=2
+pkgrel=3
 pkgdesc="A library designed to interconvert between many file formats used in 
molecular modeling and computational chemistry"
 arch=('x86_64')
 url="https://openbabel.org/wiki/Main_Page;
 license=('GPL')
-makedepends=('cmake' 'eigen' 'wxgtk' 'boost' 'python' 'swig')
-source=("https://github.com/openbabel/openbabel/releases/download/openbabel-${pkgver//./-}/openbabel-$pkgver-source.tar.bz2;)
-sha256sums=('aad58ef8deaea9f58faeecb333f87bb18e0bdf4854e3a3b188a814a8c4517259')
+makedepends=('cmake' 'eigen' 'wxgtk3' 'boost' 'python' 'swig' 'maeparser' 
'rapidjson')
+source=("https://github.com/openbabel/openbabel/releases/download/openbabel-${pkgver//./-}/openbabel-$pkgver-source.tar.bz2;
+
system-maeparser.patch::"https://github.com/openbabel/openbabel/commit/8500f8a9.patch;)
+sha256sums=('aad58ef8deaea9f58faeecb333f87bb18e0bdf4854e3a3b188a814a8c4517259'
+'14d2b019dfb3e4d6d1b8a529e5da8c2ec84b1e599b9ae74913f8548542d0ab4b')
 
 prepare() {
   mkdir -p build
+
+  cd $pkgbase-$pkgver
+  patch -p1 -i ../system-maeparser.patch # Unbundle maeparser
 }
 
 build() {
@@ -21,7 +27,7 @@
   cd build
   cmake ../openbabel-$pkgver \
 -DCMAKE_INSTALL_PREFIX=/usr \
--DwxWidgets_CONFIG_EXECUTABLE=/usr/bin/wx-config \
+-DwxWidgets_CONFIG_EXECUTABLE=/usr/bin/wx-config-gtk3 \
 -DRUN_SWIG=ON \
 -DPYTHON_BINDINGS=ON
   make
@@ -32,7 +38,7 @@
 
 package_openbabel() {
   depends=('libxml2' 'libsm')
-  optdepends=('wxgtk: GUI interface')
+  optdepends=('wxgtk3: GUI interface' 'maeparser: maestro format support')
 
   cd build
   make DESTDIR="$pkgdir" install

Added: system-maeparser.patch
===
--- system-maeparser.patch  (rev 0)
+++ system-maeparser.patch  2019-11-29 13:53:59 UTC (rev 369909)
@@ -0,0 +1,280 @@
+From e259b6737787d2545f45b63c90f0f27a40e0179f Mon Sep 17 00:00:00 2001
+From: Ricardo R-S 
+Date: Wed, 16 Oct 2019 15:57:46 -0400
+Subject: [PATCH 1/7] add Find modules for maeparser and coordgen
+
+---
+ cmake/modules/Findcoordgen.cmake  | 46 +++
+ cmake/modules/Findmaeparser.cmake | 32 +
+ 2 files changed, 78 insertions(+)
+ create mode 100644 cmake/modules/Findcoordgen.cmake
+ create mode 100644 cmake/modules/Findmaeparser.cmake
+
+diff --git a/cmake/modules/Findmaeparser.cmake 
b/cmake/modules/Findmaeparser.cmake
+new file mode 100644
+index 0..920b3ec8e
+--- /dev/null
 b/cmake/modules/Findmaeparser.cmake
+@@ -0,0 +1,32 @@
++# Try to find Schrodinger's MAEParser libraries.
++#
++# Different version handling is not yet supported
++#
++# Once found, this will find and define the following variables:
++#
++# maeparser_INCLUDE_DIRS  - maeparser's includes directory
++# maeparser_LIBRARIES - maeparser's shared libraries
++#
++#
++
++include(FindPackageHandleStandardArgs)
++
++find_path(maeparser_INCLUDE_DIRS
++NAMES "maeparser/Reader.hpp"
++HINTS ${maeparser_DIR}
++PATH_SUFFIXES "include"
++DOC "include path for maeparser"
++)
++message(STATUS "maeparser include dir set as '${maeparser_INCLUDE_DIRS}'")
++
++find_library(maeparser_LIBRARIES
++NAMES maeparser
++HINTS ${maeparser_DIR}
++PATH_SUFFIXES "lib"
++DOC "libraries for maeparser"
++)
++message(STATUS "maeparser libraries set as '${maeparser_LIBRARIES}'")
++
++find_package_handle_standard_args(maeparser FOUND_VAR maeparser_FOUND
++  REQUIRED_VARS maeparser_INCLUDE_DIRS
++  maeparser_LIBRARIES)
+
+From c4c6ef37d91c8b27e0b8af9f2e4772332caa7cf1 Mon Sep 17 00:00:00 2001
+From: Ricardo R-S 
+Date: Wed, 16 Oct 2019 15:59:18 -0400
+Subject: [PATCH 2/7] update CMakelists
+
+---
+ CMakeLists.txt | 124 ++---
+ 1 file changed, 108 insertions(+), 16 deletions(-)
+
+diff --git a/CMakeLists.txt b/CMakeLists.txt
+index e8396dd17..26edc9433 100644
+--- a/CMakeLists.txt
 b/CMakeLists.txt
+@@ -482,33 +482,65 @@ find_package(Boost)
+ if(Boost_FOUND AND BUILD_SHARED)
+ include_directories(${Boost_INCLUDE_DIRS} ${Boost_INCLUDE_DIR})
+ 

[arch-commits] Commit in openbabel/trunk (PKGBUILD)

2019-11-04 Thread Felix Yan via arch-commits
Date: Monday, November 4, 2019 @ 08:49:19
  Author: felixonmars
Revision: 366708

Python 3.8 rebuild

Modified:
  openbabel/trunk/PKGBUILD

--+
 PKGBUILD |2 +-
 1 file changed, 1 insertion(+), 1 deletion(-)

Modified: PKGBUILD
===
--- PKGBUILD2019-11-04 08:42:52 UTC (rev 366707)
+++ PKGBUILD2019-11-04 08:49:19 UTC (rev 366708)
@@ -4,7 +4,7 @@
 pkgbase=openbabel
 pkgname=(openbabel python-openbabel)
 pkgver=3.0.0
-pkgrel=1
+pkgrel=2
 pkgdesc="A library designed to interconvert between many file formats used in 
molecular modeling and computational chemistry"
 arch=('x86_64')
 url="https://openbabel.org/wiki/Main_Page;


[arch-commits] Commit in openbabel/trunk (PKGBUILD)

2019-10-12 Thread Antonio Rojas via arch-commits
Date: Saturday, October 12, 2019 @ 10:25:08
  Author: arojas
Revision: 364672

Update to 3.0.0

Modified:
  openbabel/trunk/PKGBUILD

--+
 PKGBUILD |   16 
 1 file changed, 8 insertions(+), 8 deletions(-)

Modified: PKGBUILD
===
--- PKGBUILD2019-10-12 09:11:01 UTC (rev 364671)
+++ PKGBUILD2019-10-12 10:25:08 UTC (rev 364672)
@@ -3,15 +3,15 @@
 
 pkgbase=openbabel
 pkgname=(openbabel python-openbabel)
-pkgver=2.4.1
-pkgrel=6
+pkgver=3.0.0
+pkgrel=1
 pkgdesc="A library designed to interconvert between many file formats used in 
molecular modeling and computational chemistry"
 arch=('x86_64')
 url="https://openbabel.org/wiki/Main_Page;
 license=('GPL')
-makedepends=('cmake' 'eigen' 'wxgtk' 'boost' 'python')
-source=("https://downloads.sourceforge.net/${pkgname}/${pkgname}-${pkgver}.tar.gz;)
-md5sums=('d9defcd7830b0592fece4fe54a137b99')
+makedepends=('cmake' 'eigen' 'wxgtk' 'boost' 'python' 'swig')
+source=("https://github.com/openbabel/openbabel/releases/download/openbabel-${pkgver//./-}/openbabel-$pkgver-source.tar.bz2;)
+sha256sums=('aad58ef8deaea9f58faeecb333f87bb18e0bdf4854e3a3b188a814a8c4517259')
 
 prepare() {
   mkdir -p build
@@ -19,10 +19,10 @@
 
 build() {
   cd build
-  #export CXXFLAGS+=' -std=gnu++98'
   cmake ../openbabel-$pkgver \
--DCMAKE_BUILD_TYPE=Release \
--DCMAKE_INSTALL_PREFIX=/usr 
-DwxWidgets_CONFIG_EXECUTABLE=/usr/bin/wx-config \
+-DCMAKE_INSTALL_PREFIX=/usr \
+-DwxWidgets_CONFIG_EXECUTABLE=/usr/bin/wx-config \
+-DRUN_SWIG=ON \
 -DPYTHON_BINDINGS=ON
   make
 


[arch-commits] Commit in openbabel/trunk (PKGBUILD)

2019-04-12 Thread Antonio Rojas via arch-commits
Date: Friday, April 12, 2019 @ 17:47:43
  Author: arojas
Revision: 350631

https

Modified:
  openbabel/trunk/PKGBUILD

--+
 PKGBUILD |2 +-
 1 file changed, 1 insertion(+), 1 deletion(-)

Modified: PKGBUILD
===
--- PKGBUILD2019-04-12 17:47:40 UTC (rev 350630)
+++ PKGBUILD2019-04-12 17:47:43 UTC (rev 350631)
@@ -7,7 +7,7 @@
 pkgrel=6
 pkgdesc="A library designed to interconvert between many file formats used in 
molecular modeling and computational chemistry"
 arch=('x86_64')
-url="http://openbabel.org/wiki/Main_Page;
+url="https://openbabel.org/wiki/Main_Page;
 license=('GPL')
 makedepends=('cmake' 'eigen' 'wxgtk' 'boost' 'python')
 
source=("https://downloads.sourceforge.net/${pkgname}/${pkgname}-${pkgver}.tar.gz;)


[arch-commits] Commit in openbabel/trunk (PKGBUILD)

2019-03-25 Thread Antonio Rojas via arch-commits
Date: Monday, March 25, 2019 @ 08:55:58
  Author: arojas
Revision: 349163

wxgtk 3.1 rebuild

Modified:
  openbabel/trunk/PKGBUILD

--+
 PKGBUILD |2 +-
 1 file changed, 1 insertion(+), 1 deletion(-)

Modified: PKGBUILD
===
--- PKGBUILD2019-03-25 08:51:02 UTC (rev 349162)
+++ PKGBUILD2019-03-25 08:55:58 UTC (rev 349163)
@@ -4,7 +4,7 @@
 pkgbase=openbabel
 pkgname=(openbabel python-openbabel)
 pkgver=2.4.1
-pkgrel=5
+pkgrel=6
 pkgdesc="A library designed to interconvert between many file formats used in 
molecular modeling and computational chemistry"
 arch=('x86_64')
 url="http://openbabel.org/wiki/Main_Page;


[arch-commits] Commit in openbabel/trunk (PKGBUILD)

2018-11-08 Thread Felix Yan via arch-commits
Date: Thursday, November 8, 2018 @ 12:42:17
  Author: felixonmars
Revision: 338366

update source

Modified:
  openbabel/trunk/PKGBUILD

--+
 PKGBUILD |2 +-
 1 file changed, 1 insertion(+), 1 deletion(-)

Modified: PKGBUILD
===
--- PKGBUILD2018-11-08 12:39:37 UTC (rev 338365)
+++ PKGBUILD2018-11-08 12:42:17 UTC (rev 338366)
@@ -10,7 +10,7 @@
 url="http://openbabel.org/wiki/Main_Page;
 license=('GPL')
 makedepends=('cmake' 'eigen' 'wxgtk' 'boost' 'python')
-source=("http://downloads.sourceforge.net/${pkgname}/${pkgname}-${pkgver}.tar.gz;)
+source=("https://downloads.sourceforge.net/${pkgname}/${pkgname}-${pkgver}.tar.gz;)
 md5sums=('d9defcd7830b0592fece4fe54a137b99')
 
 prepare() {


[arch-commits] Commit in openbabel/trunk (PKGBUILD)

2018-07-08 Thread Felix Yan via arch-commits
Date: Sunday, July 8, 2018 @ 10:58:34
  Author: felixonmars
Revision: 328055

Python 3.7 rebuild

Modified:
  openbabel/trunk/PKGBUILD

--+
 PKGBUILD |2 +-
 1 file changed, 1 insertion(+), 1 deletion(-)

Modified: PKGBUILD
===
--- PKGBUILD2018-07-08 08:10:40 UTC (rev 328054)
+++ PKGBUILD2018-07-08 10:58:34 UTC (rev 328055)
@@ -5,7 +5,7 @@
 pkgbase=openbabel
 pkgname=(openbabel python-openbabel)
 pkgver=2.4.1
-pkgrel=4
+pkgrel=5
 pkgdesc="A library designed to interconvert between many file formats used in 
molecular modeling and computational chemistry"
 arch=('x86_64')
 url="http://openbabel.org/wiki/Main_Page;


[arch-commits] Commit in openbabel/trunk (PKGBUILD)

2017-01-19 Thread Jelle van der Waa
Date: Thursday, January 19, 2017 @ 19:23:59
  Author: jelle
Revision: 286995

upgpkg: openbabel 2.4.1-4

use wxgtk instead of the to be removed wxgtk2.8

Modified:
  openbabel/trunk/PKGBUILD

--+
 PKGBUILD |2 +-
 1 file changed, 1 insertion(+), 1 deletion(-)

Modified: PKGBUILD
===
--- PKGBUILD2017-01-19 19:21:47 UTC (rev 286994)
+++ PKGBUILD2017-01-19 19:23:59 UTC (rev 286995)
@@ -20,7 +20,7 @@
 
 build() {
   cd build
-  export CXXFLAGS+=' -std=gnu++98'
+  #export CXXFLAGS+=' -std=gnu++98'
   cmake ../openbabel-$pkgver \
 -DCMAKE_BUILD_TYPE=Release \
 -DCMAKE_INSTALL_PREFIX=/usr 
-DwxWidgets_CONFIG_EXECUTABLE=/usr/bin/wx-config \


[arch-commits] Commit in openbabel/trunk (PKGBUILD)

2017-01-19 Thread Jelle van der Waa
Date: Thursday, January 19, 2017 @ 17:36:05
  Author: jelle
Revision: 286989

upgpkg: openbabel 2.4.1-4

use wxgtk instead of the to be removed wxgtk2.8

Modified:
  openbabel/trunk/PKGBUILD

--+
 PKGBUILD |8 
 1 file changed, 4 insertions(+), 4 deletions(-)

Modified: PKGBUILD
===
--- PKGBUILD2017-01-19 17:27:59 UTC (rev 286988)
+++ PKGBUILD2017-01-19 17:36:05 UTC (rev 286989)
@@ -5,12 +5,12 @@
 pkgbase=openbabel
 pkgname=(openbabel python-openbabel)
 pkgver=2.4.1
-pkgrel=3
+pkgrel=4
 pkgdesc="A library designed to interconvert between many file formats used in 
molecular modeling and computational chemistry"
 arch=('i686' 'x86_64')
 url="http://openbabel.org/wiki/Main_Page;
 license=('GPL')
-makedepends=('cmake' 'eigen' 'wxgtk2.8' 'boost' 'python')
+makedepends=('cmake' 'eigen' 'wxgtk' 'boost' 'python')
 
source=("http://downloads.sourceforge.net/${pkgname}/${pkgname}-${pkgver}.tar.gz;)
 md5sums=('d9defcd7830b0592fece4fe54a137b99')
 
@@ -23,7 +23,7 @@
   export CXXFLAGS+=' -std=gnu++98'
   cmake ../openbabel-$pkgver \
 -DCMAKE_BUILD_TYPE=Release \
--DCMAKE_INSTALL_PREFIX=/usr 
-DwxWidgets_CONFIG_EXECUTABLE=/usr/bin/wx-config-2.8 \
+-DCMAKE_INSTALL_PREFIX=/usr 
-DwxWidgets_CONFIG_EXECUTABLE=/usr/bin/wx-config \
 -DPYTHON_BINDINGS=ON
   make
 
@@ -33,7 +33,7 @@
 
 package_openbabel() {
   depends=('libxml2' 'libsm')
-  optdepends=('wxgtk2.8: GUI interface')
+  optdepends=('wxgtk: GUI interface')
 
   cd build
   make DESTDIR="$pkgdir" install


[arch-commits] Commit in openbabel/trunk (PKGBUILD)

2016-12-25 Thread Felix Yan
Date: Sunday, December 25, 2016 @ 18:42:50
  Author: felixonmars
Revision: 284769

Python 3.6 rebuild

Modified:
  openbabel/trunk/PKGBUILD

--+
 PKGBUILD |2 +-
 1 file changed, 1 insertion(+), 1 deletion(-)

Modified: PKGBUILD
===
--- PKGBUILD2016-12-25 18:42:49 UTC (rev 284768)
+++ PKGBUILD2016-12-25 18:42:50 UTC (rev 284769)
@@ -5,7 +5,7 @@
 pkgbase=openbabel
 pkgname=(openbabel python-openbabel)
 pkgver=2.4.1
-pkgrel=2
+pkgrel=3
 pkgdesc="A library designed to interconvert between many file formats used in 
molecular modeling and computational chemistry"
 arch=('i686' 'x86_64')
 url="http://openbabel.org/wiki/Main_Page;


[arch-commits] Commit in openbabel/trunk (PKGBUILD)

2016-12-23 Thread Felix Yan
Date: Saturday, December 24, 2016 @ 03:31:27
  Author: felixonmars
Revision: 284536

upgpkg: openbabel 2.4.1-2

merge python-openbabel here

Modified:
  openbabel/trunk/PKGBUILD

--+
 PKGBUILD |   29 +
 1 file changed, 21 insertions(+), 8 deletions(-)

Modified: PKGBUILD
===
--- PKGBUILD2016-12-23 21:31:30 UTC (rev 284535)
+++ PKGBUILD2016-12-24 03:31:27 UTC (rev 284536)
@@ -2,16 +2,15 @@
 # Maintainer: Andrea Scarpino 
 # Contributor: Damir Perisa 
 
-pkgname=openbabel
+pkgbase=openbabel
+pkgname=(openbabel python-openbabel)
 pkgver=2.4.1
-pkgrel=1
+pkgrel=2
 pkgdesc="A library designed to interconvert between many file formats used in 
molecular modeling and computational chemistry"
 arch=('i686' 'x86_64')
 url="http://openbabel.org/wiki/Main_Page;
 license=('GPL')
-depends=('gcc-libs' 'libxml2' 'libsm')
-makedepends=('cmake' 'eigen' 'wxgtk2.8' 'boost')
-optdepends=('wxgtk2.8: GUI interface')
+makedepends=('cmake' 'eigen' 'wxgtk2.8' 'boost' 'python')
 
source=("http://downloads.sourceforge.net/${pkgname}/${pkgname}-${pkgver}.tar.gz;)
 md5sums=('d9defcd7830b0592fece4fe54a137b99')
 
@@ -22,13 +21,27 @@
 build() {
   cd build
   export CXXFLAGS+=' -std=gnu++98'
-  cmake ../$pkgname-$pkgver \
+  cmake ../openbabel-$pkgver \
 -DCMAKE_BUILD_TYPE=Release \
--DCMAKE_INSTALL_PREFIX=/usr 
-DwxWidgets_CONFIG_EXECUTABLE=/usr/bin/wx-config-2.8
+-DCMAKE_INSTALL_PREFIX=/usr 
-DwxWidgets_CONFIG_EXECUTABLE=/usr/bin/wx-config-2.8 \
+-DPYTHON_BINDINGS=ON
   make
+
+  # To split python bindings
+  sed -i '/scripts.cmake_install.cmake/d' cmake_install.cmake
 }
 
-package() {
+package_openbabel() {
+  depends=('libxml2' 'libsm')
+  optdepends=('wxgtk2.8: GUI interface')
+
   cd build
   make DESTDIR="$pkgdir" install
 }
+
+package_python-openbabel() {
+  depends=('python' 'openbabel')
+
+  cd build/scripts
+  make DESTDIR="$pkgdir" install
+}


[arch-commits] Commit in openbabel/trunk (PKGBUILD gcc-5.patch)

2016-12-21 Thread Felix Yan
Date: Wednesday, December 21, 2016 @ 09:46:13
  Author: felixonmars
Revision: 284368

upgpkg: openbabel 2.4.1-1

Modified:
  openbabel/trunk/PKGBUILD
Deleted:
  openbabel/trunk/gcc-5.patch

-+
 PKGBUILD|   13 -
 gcc-5.patch |   12 
 2 files changed, 4 insertions(+), 21 deletions(-)

Modified: PKGBUILD
===
--- PKGBUILD2016-12-21 07:33:11 UTC (rev 284367)
+++ PKGBUILD2016-12-21 09:46:13 UTC (rev 284368)
@@ -3,8 +3,8 @@
 # Contributor: Damir Perisa 
 
 pkgname=openbabel
-pkgver=2.3.2
-pkgrel=6
+pkgver=2.4.1
+pkgrel=1
 pkgdesc="A library designed to interconvert between many file formats used in 
molecular modeling and computational chemistry"
 arch=('i686' 'x86_64')
 url="http://openbabel.org/wiki/Main_Page;
@@ -12,16 +12,11 @@
 depends=('gcc-libs' 'libxml2' 'libsm')
 makedepends=('cmake' 'eigen' 'wxgtk2.8' 'boost')
 optdepends=('wxgtk2.8: GUI interface')
-source=("http://downloads.sourceforge.net/${pkgname}/${pkgname}-${pkgver}.tar.gz;
 'gcc-5.patch')
-md5sums=('9b0007560d9d838b40ab4ad06daf5610'
- '0821ec915b2ab52d54658dc83f5a93d8')
+source=("http://downloads.sourceforge.net/${pkgname}/${pkgname}-${pkgver}.tar.gz;)
+md5sums=('d9defcd7830b0592fece4fe54a137b99')
 
 prepare() {
   mkdir -p build
-
-  cd $pkgname-$pkgver
-# Fix build with GCC 5 (Fedora)
-  patch -p0 -i "$srcdir"/gcc-5.patch
 }
 
 build() {

Deleted: gcc-5.patch
===
--- gcc-5.patch 2016-12-21 07:33:11 UTC (rev 284367)
+++ gcc-5.patch 2016-12-21 09:46:13 UTC (rev 284368)
@@ -1,12 +0,0 @@
 include/openbabel/shared_ptr.h.gcc52015-02-04 20:04:57.0 
+0100
-+++ include/openbabel/shared_ptr.h 2015-02-07 22:10:37.433163644 +0100
-@@ -21,7 +21,7 @@ GNU General Public License for more deta
-   #define sharedptr boost::shared_ptr
- #else
-   #include 
--  #if __GNUC__ == 4  //&& __GNUC_MINOR__ < 3  removed at the suggestion of 
Konstantin Tokarev
-+  #if __GNUC__ >= 4  //&& __GNUC_MINOR__ < 3  removed at the suggestion of 
Konstantin Tokarev
- #include 
-   #endif
-   using std::tr1::shared_ptr;
-


[arch-commits] Commit in openbabel/trunk (PKGBUILD)

2016-07-08 Thread Antonio Rojas
Date: Friday, July 8, 2016 @ 06:05:33
  Author: arojas
Revision: 271177

Use eigen3

Modified:
  openbabel/trunk/PKGBUILD

--+
 PKGBUILD |8 
 1 file changed, 4 insertions(+), 4 deletions(-)

Modified: PKGBUILD
===
--- PKGBUILD2016-07-08 05:42:31 UTC (rev 271176)
+++ PKGBUILD2016-07-08 06:05:33 UTC (rev 271177)
@@ -4,15 +4,14 @@
 
 pkgname=openbabel
 pkgver=2.3.2
-pkgrel=5
+pkgrel=6
 pkgdesc="A library designed to interconvert between many file formats used in 
molecular modeling and computational chemistry"
 arch=('i686' 'x86_64')
 url="http://openbabel.org/wiki/Main_Page;
 license=('GPL')
 depends=('gcc-libs' 'libxml2' 'libsm')
-makedepends=('cmake' 'eigen2' 'wxgtk2.8' 'boost')
-optdepends=('eigen2: to use bindings'
-'wxgtk2.8: GUI interface')
+makedepends=('cmake' 'eigen' 'wxgtk2.8' 'boost')
+optdepends=('wxgtk2.8: GUI interface')
 
source=("http://downloads.sourceforge.net/${pkgname}/${pkgname}-${pkgver}.tar.gz;
 'gcc-5.patch')
 md5sums=('9b0007560d9d838b40ab4ad06daf5610'
  '0821ec915b2ab52d54658dc83f5a93d8')
@@ -27,6 +26,7 @@
 
 build() {
   cd build
+  export CXXFLAGS+=' -std=gnu++98'
   cmake ../$pkgname-$pkgver \
 -DCMAKE_BUILD_TYPE=Release \
 -DCMAKE_INSTALL_PREFIX=/usr 
-DwxWidgets_CONFIG_EXECUTABLE=/usr/bin/wx-config-2.8


[arch-commits] Commit in openbabel/trunk (PKGBUILD)

2015-12-07 Thread Bartłomiej Piotrowski
Date: Monday, December 7, 2015 @ 09:16:28
  Author: bpiotrowski
Revision: 253294

C++11 ABI rebuild

Modified:
  openbabel/trunk/PKGBUILD

--+
 PKGBUILD |2 +-
 1 file changed, 1 insertion(+), 1 deletion(-)

Modified: PKGBUILD
===
--- PKGBUILD2015-12-07 08:07:41 UTC (rev 253293)
+++ PKGBUILD2015-12-07 08:16:28 UTC (rev 253294)
@@ -4,7 +4,7 @@
 
 pkgname=openbabel
 pkgver=2.3.2
-pkgrel=4
+pkgrel=5
 pkgdesc="A library designed to interconvert between many file formats used in 
molecular modeling and computational chemistry"
 arch=('i686' 'x86_64')
 url="http://openbabel.org/wiki/Main_Page;


[arch-commits] Commit in openbabel/trunk (PKGBUILD)

2015-05-30 Thread Antonio Rojas
Date: Saturday, May 30, 2015 @ 12:02:50
  Author: arojas
Revision: 239903

Fix build with GCC 5

Modified:
  openbabel/trunk/PKGBUILD

--+
 PKGBUILD |   25 -
 1 file changed, 16 insertions(+), 9 deletions(-)

Modified: PKGBUILD
===
--- PKGBUILD2015-05-30 09:12:31 UTC (rev 239902)
+++ PKGBUILD2015-05-30 10:02:50 UTC (rev 239903)
@@ -4,23 +4,30 @@
 
 pkgname=openbabel
 pkgver=2.3.2
-pkgrel=3
+pkgrel=4
 pkgdesc=A library designed to interconvert between many file formats used in 
molecular modeling and computational chemistry
 arch=('i686' 'x86_64')
 url=http://openbabel.org/wiki/Main_Page;
 license=('GPL')
 depends=('gcc-libs' 'libxml2' 'libsm')
-makedepends=('cmake' 'eigen2' 'wxgtk2.8')
+makedepends=('cmake' 'eigen2' 'wxgtk2.8' 'boost')
 optdepends=('eigen2: to use bindings'
 'wxgtk2.8: GUI interface')
-source=(http://downloads.sourceforge.net/${pkgname}/${pkgname}-${pkgver}.tar.gz;)
-md5sums=('9b0007560d9d838b40ab4ad06daf5610')
+source=(http://downloads.sourceforge.net/${pkgname}/${pkgname}-${pkgver}.tar.gz;
 'gcc-5.patch')
+md5sums=('9b0007560d9d838b40ab4ad06daf5610'
+ '0821ec915b2ab52d54658dc83f5a93d8')
 
+prepare() {
+  mkdir -p build
+
+  cd $pkgname-$pkgver
+# Fix build with GCC 5 (Fedora)
+  patch -p0 -i $srcdir/gcc-5.patch
+}
+
 build() {
-  cd ${srcdir}
-  mkdir build
   cd build
-  cmake ../${pkgname}-${pkgver} \
+  cmake ../$pkgname-$pkgver \
 -DCMAKE_BUILD_TYPE=Release \
 -DCMAKE_INSTALL_PREFIX=/usr 
-DwxWidgets_CONFIG_EXECUTABLE=/usr/bin/wx-config-2.8
   make
@@ -27,6 +34,6 @@
 }
 
 package() {
-  cd ${srcdir}/build
-  make DESTDIR=${pkgdir} install
+  cd build
+  make DESTDIR=$pkgdir install
 }


[arch-commits] Commit in openbabel/trunk (PKGBUILD)

2014-01-13 Thread Eric Bélanger
Date: Monday, January 13, 2014 @ 10:49:02
  Author: eric
Revision: 203533

upgpkg: openbabel 2.3.2-3

Switch to wxgtk2.8 to fix unknown symbol and buils issues (close FS#38470)

Modified:
  openbabel/trunk/PKGBUILD

--+
 PKGBUILD |8 
 1 file changed, 4 insertions(+), 4 deletions(-)

Modified: PKGBUILD
===
--- PKGBUILD2014-01-13 02:05:53 UTC (rev 203532)
+++ PKGBUILD2014-01-13 09:49:02 UTC (rev 203533)
@@ -4,15 +4,15 @@
 
 pkgname=openbabel
 pkgver=2.3.2
-pkgrel=2
+pkgrel=3
 pkgdesc=A library designed to interconvert between many file formats used in 
molecular modeling and computational chemistry
 arch=('i686' 'x86_64')
 url=http://openbabel.org/wiki/Main_Page;
 license=('GPL')
 depends=('gcc-libs' 'libxml2' 'libsm')
-makedepends=('cmake' 'eigen2' 'wxgtk')
+makedepends=('cmake' 'eigen2' 'wxgtk2.8')
 optdepends=('eigen2: to use bindings'
-'wxgtk: GUI interface')
+'wxgtk2.8: GUI interface')
 
source=(http://downloads.sourceforge.net/${pkgname}/${pkgname}-${pkgver}.tar.gz;)
 md5sums=('9b0007560d9d838b40ab4ad06daf5610')
 
@@ -22,7 +22,7 @@
   cd build
   cmake ../${pkgname}-${pkgver} \
 -DCMAKE_BUILD_TYPE=Release \
--DCMAKE_INSTALL_PREFIX=/usr
+-DCMAKE_INSTALL_PREFIX=/usr 
-DwxWidgets_CONFIG_EXECUTABLE=/usr/bin/wx-config-2.8
   make
 }
 



[arch-commits] Commit in openbabel/trunk (PKGBUILD)

2014-01-05 Thread Bartłomiej Piotrowski
Date: Sunday, January 5, 2014 @ 23:23:30
  Author: bpiotrowski
Revision: 203225

upgpkg: openbabel 2.3.2-2

rebuild against wxgtk 3.0.0

Modified:
  openbabel/trunk/PKGBUILD

--+
 PKGBUILD |6 +++---
 1 file changed, 3 insertions(+), 3 deletions(-)

Modified: PKGBUILD
===
--- PKGBUILD2014-01-05 21:21:46 UTC (rev 203224)
+++ PKGBUILD2014-01-05 22:23:30 UTC (rev 203225)
@@ -4,15 +4,15 @@
 
 pkgname=openbabel
 pkgver=2.3.2
-pkgrel=1
+pkgrel=2
 pkgdesc=A library designed to interconvert between many file formats used in 
molecular modeling and computational chemistry
 arch=('i686' 'x86_64')
 url=http://openbabel.org/wiki/Main_Page;
 license=('GPL')
-depends=('gcc-libs' 'libxml2')
+depends=('gcc-libs' 'libxml2' 'libsm')
 makedepends=('cmake' 'eigen2' 'wxgtk')
 optdepends=('eigen2: to use bindings'
-'wxgtk: GUI interface')
+'wxgtk: GUI interface')
 
source=(http://downloads.sourceforge.net/${pkgname}/${pkgname}-${pkgver}.tar.gz;)
 md5sums=('9b0007560d9d838b40ab4ad06daf5610')
 



[arch-commits] Commit in openbabel/trunk (PKGBUILD)

2012-11-21 Thread Eric Bélanger
Date: Wednesday, November 21, 2012 @ 11:06:56
  Author: eric
Revision: 171705

upgpkg: openbabel 2.3.2-1

Upstream update, Update make/optdepends

Modified:
  openbabel/trunk/PKGBUILD

--+
 PKGBUILD |8 
 1 file changed, 4 insertions(+), 4 deletions(-)

Modified: PKGBUILD
===
--- PKGBUILD2012-11-21 16:06:05 UTC (rev 171704)
+++ PKGBUILD2012-11-21 16:06:56 UTC (rev 171705)
@@ -3,19 +3,19 @@
 # Contributor: Damir Perisa damir.per...@bluewin.ch
 
 pkgname=openbabel
-pkgver=2.3.1
+pkgver=2.3.2
 pkgrel=1
 pkgdesc=A library designed to interconvert between many file formats used in 
molecular modeling and computational chemistry
 arch=('i686' 'x86_64')
 url=http://openbabel.org/wiki/Main_Page;
 license=('GPL')
 depends=('gcc-libs' 'libxml2')
-makedepends=('cmake' 'eigen' 'wxgtk')
-optdepends=('eigen: to use bindings'
+makedepends=('cmake' 'eigen2' 'wxgtk')
+optdepends=('eigen2: to use bindings'
 'wxgtk: GUI interface')
 options=('!libtool')
 
source=(http://downloads.sourceforge.net/${pkgname}/${pkgname}-${pkgver}.tar.gz;)
-md5sums=('1f029b0add12a3b55582dc2c832b04f8')
+md5sums=('9b0007560d9d838b40ab4ad06daf5610')
 
 build() {
   cd ${srcdir}



[arch-commits] Commit in openbabel/trunk (PKGBUILD)

2011-10-17 Thread Eric Bélanger
Date: Monday, October 17, 2011 @ 22:33:55
  Author: eric
Revision: 140671

upgpkg: openbabel 2.3.1-1

Upstream update

Modified:
  openbabel/trunk/PKGBUILD

--+
 PKGBUILD |   15 +++
 1 file changed, 7 insertions(+), 8 deletions(-)

Modified: PKGBUILD
===
--- PKGBUILD2011-10-18 01:14:15 UTC (rev 140670)
+++ PKGBUILD2011-10-18 02:33:55 UTC (rev 140671)
@@ -3,10 +3,9 @@
 # Contributor: Damir Perisa damir.per...@bluewin.ch
 
 pkgname=openbabel
-pkgver=2.3.0
-pkgrel=3
-pkgdesc=A library designed to interconvert between many file formats used in \
-molecular modeling and computational chemistry
+pkgver=2.3.1
+pkgrel=1
+pkgdesc=A library designed to interconvert between many file formats used in 
molecular modeling and computational chemistry
 arch=('i686' 'x86_64')
 url=http://openbabel.org/wiki/Main_Page;
 license=('GPL')
@@ -16,10 +15,10 @@
 'wxgtk: GUI interface')
 options=('!libtool')
 
source=(http://downloads.sourceforge.net/${pkgname}/${pkgname}-${pkgver}.tar.gz;)
-md5sums=('effda01ed4a31d18d8e3d08191799608')
+md5sums=('1f029b0add12a3b55582dc2c832b04f8')
 
 build() {
-  cd ${srcdir}
+  cd ${srcdir}
   mkdir build
   cd build
   cmake ../${pkgname}-${pkgver} \
@@ -29,6 +28,6 @@
 }
 
 package() {
-  cd ${srcdir}/build
-  make DESTDIR=${pkgdir} install
+  cd ${srcdir}/build
+  make DESTDIR=${pkgdir} install
 }



[arch-commits] Commit in openbabel/trunk (PKGBUILD)

2010-11-18 Thread Andrea Scarpino
Date: Thursday, November 18, 2010 @ 15:52:23
  Author: andrea
Revision: 99851

upgpkg: openbabel 2.3.0-3
add openbabel GUI and move eigen to optdeps (FS#21730)

Modified:
  openbabel/trunk/PKGBUILD

--+
 PKGBUILD |   11 ++-
 1 file changed, 6 insertions(+), 5 deletions(-)

Modified: PKGBUILD
===
--- PKGBUILD2010-11-18 18:45:25 UTC (rev 99850)
+++ PKGBUILD2010-11-18 20:52:23 UTC (rev 99851)
@@ -4,14 +4,16 @@
 
 pkgname=openbabel
 pkgver=2.3.0
-pkgrel=2
+pkgrel=3
 pkgdesc=A library designed to interconvert between many file formats used in \
 molecular modeling and computational chemistry
 arch=('i686' 'x86_64')
 url=http://openbabel.org/wiki/Main_Page;
 license=('GPL')
-depends=('gcc-libs' 'libxml2' 'eigen')
-makedepends=('cmake')
+depends=('gcc-libs' 'libxml2')
+makedepends=('cmake' 'eigen' 'wxgtk')
+optdepends=('eigen: to use bindings'
+'wxgtk: GUI interface')
 options=('!libtool')
 
source=(http://downloads.sourceforge.net/${pkgname}/${pkgname}-${pkgver}.tar.gz;)
 md5sums=('effda01ed4a31d18d8e3d08191799608')
@@ -22,8 +24,7 @@
   cd build
   cmake ../${pkgname}-${pkgver} \
 -DCMAKE_BUILD_TYPE=Release \
--DCMAKE_INSTALL_PREFIX=/usr \
--DBUILD_GUI=OFF
+-DCMAKE_INSTALL_PREFIX=/usr
   make
 }
 



[arch-commits] Commit in openbabel/trunk (PKGBUILD)

2010-11-17 Thread Andrea Scarpino
Date: Wednesday, November 17, 2010 @ 05:48:34
  Author: andrea
Revision: 99747

eigen is needed to use bindings (FS#21708)

Modified:
  openbabel/trunk/PKGBUILD

--+
 PKGBUILD |7 ++-
 1 file changed, 2 insertions(+), 5 deletions(-)

Modified: PKGBUILD
===
--- PKGBUILD2010-11-17 10:37:07 UTC (rev 99746)
+++ PKGBUILD2010-11-17 10:48:34 UTC (rev 99747)
@@ -4,13 +4,13 @@
 
 pkgname=openbabel
 pkgver=2.3.0
-pkgrel=1
+pkgrel=2
 pkgdesc=A library designed to interconvert between many file formats used in \
 molecular modeling and computational chemistry
 arch=('i686' 'x86_64')
 url=http://openbabel.org/wiki/Main_Page;
 license=('GPL')
-depends=('gcc-libs' 'libxml2')
+depends=('gcc-libs' 'libxml2' 'eigen')
 makedepends=('cmake')
 options=('!libtool')
 
source=(http://downloads.sourceforge.net/${pkgname}/${pkgname}-${pkgver}.tar.gz;)
@@ -23,9 +23,6 @@
   cmake ../${pkgname}-${pkgver} \
 -DCMAKE_BUILD_TYPE=Release \
 -DCMAKE_INSTALL_PREFIX=/usr \
--DPYTHON_BINDINGS=OFF \
--DRUBY_BINDINGS=OFF \
--DPERL_BINDINGS=OFF \
 -DBUILD_GUI=OFF
   make
 }



[arch-commits] Commit in openbabel/trunk (PKGBUILD)

2010-11-11 Thread Andrea Scarpino
Date: Thursday, November 11, 2010 @ 14:02:31
  Author: andrea
Revision: 98599

upgpkg: openbabel 2.3.0-1
upstream release

Modified:
  openbabel/trunk/PKGBUILD

--+
 PKGBUILD |   25 +
 1 file changed, 17 insertions(+), 8 deletions(-)

Modified: PKGBUILD
===
--- PKGBUILD2010-11-11 17:28:00 UTC (rev 98598)
+++ PKGBUILD2010-11-11 19:02:31 UTC (rev 98599)
@@ -3,24 +3,33 @@
 # Contributor: Damir Perisa damir.per...@bluewin.ch
 
 pkgname=openbabel
-pkgver=2.2.3
+pkgver=2.3.0
 pkgrel=1
-pkgdesc=A library designed to interconvert between many file formats used in 
molecular modeling and computational chemistry
+pkgdesc=A library designed to interconvert between many file formats used in
+molecular modeling and computational chemistry
 arch=('i686' 'x86_64')
 url=http://openbabel.org/wiki/Main_Page;
 license=('GPL')
 depends=('gcc-libs' 'libxml2')
+makedepends=('cmake')
 options=('!libtool')
 
source=(http://downloads.sourceforge.net/${pkgname}/${pkgname}-${pkgver}.tar.gz;)
-md5sums=('7ea8845c54d6d3a9be378c78088af804')
+md5sums=('effda01ed4a31d18d8e3d08191799608')
 
 build() {
-  cd ${srcdir}/${pkgname}-${pkgver}
-  ./configure --prefix=/usr
-  make || return 1
+  cd ${srcdir}
+  mkdir build
+  cd build
+  cmake ../${pkgname}-${pkgver} \
+-DCMAKE_BUILD_TYPE=Release \
+-DCMAKE_INSTALL_PREFIX=/usr \
+-DRUBY_BINDINGS=OFF \
+-DPERL_BINDINGS=OFF \
+-DBUILD_GUI=OFF
+  make
 }
 
 package() {
-  cd ${srcdir}/${pkgname}-${pkgver}
-  make prefix=${pkgdir}/usr install || return 1
+  cd ${srcdir}/build
+  make DESTDIR=${pkgdir} install
 }



[arch-commits] Commit in openbabel/trunk (PKGBUILD)

2010-11-11 Thread Andrea Scarpino
Date: Thursday, November 11, 2010 @ 14:10:18
  Author: andrea
Revision: 98604

fix pkgdesc

Modified:
  openbabel/trunk/PKGBUILD

--+
 PKGBUILD |   20 ++--
 1 file changed, 10 insertions(+), 10 deletions(-)

Modified: PKGBUILD
===
--- PKGBUILD2010-11-11 19:05:35 UTC (rev 98603)
+++ PKGBUILD2010-11-11 19:10:18 UTC (rev 98604)
@@ -5,8 +5,8 @@
 pkgname=openbabel
 pkgver=2.3.0
 pkgrel=1
-pkgdesc=A library designed to interconvert between many file formats used in
-molecular modeling and computational chemistry
+pkgdesc=A library designed to interconvert between many file formats used in \
+molecular modeling and computational chemistry
 arch=('i686' 'x86_64')
 url=http://openbabel.org/wiki/Main_Page;
 license=('GPL')
@@ -20,16 +20,16 @@
   cd ${srcdir}
   mkdir build
   cd build
-  cmake ../${pkgname}-${pkgver} \
--DCMAKE_BUILD_TYPE=Release \
--DCMAKE_INSTALL_PREFIX=/usr \
--DRUBY_BINDINGS=OFF \
--DPERL_BINDINGS=OFF \
--DBUILD_GUI=OFF
-  make
+#  cmake ../${pkgname}-${pkgver} \
+#-DCMAKE_BUILD_TYPE=Release \
+#-DCMAKE_INSTALL_PREFIX=/usr \
+#-DRUBY_BINDINGS=OFF \
+#-DPERL_BINDINGS=OFF \
+#-DBUILD_GUI=OFF
+#  make
 }
 
 package() {
   cd ${srcdir}/build
-  make DESTDIR=${pkgdir} install
+#  make DESTDIR=${pkgdir} install
 }



[arch-commits] Commit in openbabel/trunk (PKGBUILD)

2010-11-11 Thread Andrea Scarpino
Date: Thursday, November 11, 2010 @ 14:10:54
  Author: andrea
Revision: 98605

ops..

Modified:
  openbabel/trunk/PKGBUILD

--+
 PKGBUILD |   16 
 1 file changed, 8 insertions(+), 8 deletions(-)

Modified: PKGBUILD
===
--- PKGBUILD2010-11-11 19:10:18 UTC (rev 98604)
+++ PKGBUILD2010-11-11 19:10:54 UTC (rev 98605)
@@ -20,16 +20,16 @@
   cd ${srcdir}
   mkdir build
   cd build
-#  cmake ../${pkgname}-${pkgver} \
-#-DCMAKE_BUILD_TYPE=Release \
-#-DCMAKE_INSTALL_PREFIX=/usr \
-#-DRUBY_BINDINGS=OFF \
-#-DPERL_BINDINGS=OFF \
-#-DBUILD_GUI=OFF
-#  make
+  cmake ../${pkgname}-${pkgver} \
+-DCMAKE_BUILD_TYPE=Release \
+-DCMAKE_INSTALL_PREFIX=/usr \
+-DRUBY_BINDINGS=OFF \
+-DPERL_BINDINGS=OFF \
+-DBUILD_GUI=OFF
+  make
 }
 
 package() {
   cd ${srcdir}/build
-#  make DESTDIR=${pkgdir} install
+  make DESTDIR=${pkgdir} install
 }



[arch-commits] Commit in openbabel/trunk (PKGBUILD)

2010-11-11 Thread Andrea Scarpino
Date: Thursday, November 11, 2010 @ 14:19:56
  Author: andrea
Revision: 98606

also disable python buildings

Modified:
  openbabel/trunk/PKGBUILD

--+
 PKGBUILD |1 +
 1 file changed, 1 insertion(+)

Modified: PKGBUILD
===
--- PKGBUILD2010-11-11 19:10:54 UTC (rev 98605)
+++ PKGBUILD2010-11-11 19:19:56 UTC (rev 98606)
@@ -23,6 +23,7 @@
   cmake ../${pkgname}-${pkgver} \
 -DCMAKE_BUILD_TYPE=Release \
 -DCMAKE_INSTALL_PREFIX=/usr \
+-DPYTHON_BINDINGS=OFF \
 -DRUBY_BINDINGS=OFF \
 -DPERL_BINDINGS=OFF \
 -DBUILD_GUI=OFF



[arch-commits] Commit in openbabel/trunk (PKGBUILD)

2010-06-09 Thread Andrea Scarpino
Date: Wednesday, June 9, 2010 @ 15:21:38
  Author: andrea
Revision: 82269

fix url

Modified:
  openbabel/trunk/PKGBUILD

--+
 PKGBUILD |   15 +--
 1 file changed, 9 insertions(+), 6 deletions(-)

Modified: PKGBUILD
===
--- PKGBUILD2010-06-09 19:13:35 UTC (rev 82268)
+++ PKGBUILD2010-06-09 19:21:38 UTC (rev 82269)
@@ -5,19 +5,22 @@
 pkgname=openbabel
 pkgver=2.2.3
 pkgrel=1
-pkgdesc=A library designed to interconvert between many file formats used in 
molecular modeling and computational chemistry.
+pkgdesc=A library designed to interconvert between many file formats used in 
molecular modeling and computational chemistry
 arch=('i686' 'x86_64')
-url=http://openbabel.sourceforge.net/;
+url=http://openbabel.org/wiki/Main_Page;
 license=('GPL')
 depends=('gcc-libs' 'libxml2')
 options=('!libtool')
-source=(http://downloads.sourceforge.net/$pkgname/$pkgname-$pkgver.tar.gz;)
+source=(http://downloads.sourceforge.net/${pkgname}/${pkgname}-${pkgver}.tar.gz;)
 md5sums=('7ea8845c54d6d3a9be378c78088af804')
 
 build() {
-  cd ${srcdir}/$pkgname-$pkgver
-
+  cd ${srcdir}/${pkgname}-${pkgver}
   ./configure --prefix=/usr
   make || return 1
-  make prefix=${pkgdir}/usr install
 }
+
+package() {
+  cd ${srcdir}/${pkgname}-${pkgver}
+  make prefix=${pkgdir}/usr install || return 1
+}