commit: 6c5c8cd609d14bdd32cd87ece2b7a0383a34d2e2
Author: Honza Macháček <Hloupy.Honza <AT> centrum <DOT> cz>
AuthorDate: Mon Jan 5 16:18:16 2015 +0000
Commit: Honza Macháček <Hloupy.Honza <AT> centrum <DOT> cz>
CommitDate: Mon Jan 5 16:18:16 2015 +0000
URL: http://sources.gentoo.org/gitweb/?p=proj/sci.git;a=commit;h=6c5c8cd6
2 new upstream patches of sci-chemistry/nwchem-6.5_p26243 added, USE_NOIO unset
(disables semidirect calculations, introduced by mistake)
Package-Manager: portage-2.2.15
---
sci-chemistry/nwchem/ChangeLog | 9 ++++++++-
.../{nwchem-6.5_p26243-r3.ebuild => nwchem-6.5_p26243-r4.ebuild} | 9 +++++----
2 files changed, 13 insertions(+), 5 deletions(-)
diff --git a/sci-chemistry/nwchem/ChangeLog b/sci-chemistry/nwchem/ChangeLog
index c88a1d3..21a81b9 100644
--- a/sci-chemistry/nwchem/ChangeLog
+++ b/sci-chemistry/nwchem/ChangeLog
@@ -1,7 +1,14 @@
# ChangeLog for sci-chemistry/nwchem
-# Copyright 1999-2014 Gentoo Foundation; Distributed under the GPL v2
+# Copyright 1999-2015 Gentoo Foundation; Distributed under the GPL v2
# $Header: $
+*nwchem-6.5_p26243-r4 (05 Jan 2015)
+
+ 05 Jan 2015; Honza Macháček <[email protected]>
+ -nwchem-6.5_p26243-r3.ebuild, +nwchem-6.5_p26243-r4.ebuild:
+ 2 new upstream patches added, USE_NOIO unset (disables semidirect
+ calculations, introduced by mistake)
+
*nwchem-6.5_p26243-r3 (17 Dec 2014)
17 Dec 2014; Honza Macháček <[email protected]>
diff --git a/sci-chemistry/nwchem/nwchem-6.5_p26243-r3.ebuild
b/sci-chemistry/nwchem/nwchem-6.5_p26243-r4.ebuild
similarity index 96%
rename from sci-chemistry/nwchem/nwchem-6.5_p26243-r3.ebuild
rename to sci-chemistry/nwchem/nwchem-6.5_p26243-r4.ebuild
index 77dfb13..f740f4a 100644
--- a/sci-chemistry/nwchem/nwchem-6.5_p26243-r3.ebuild
+++ b/sci-chemistry/nwchem/nwchem-6.5_p26243-r4.ebuild
@@ -1,4 +1,4 @@
-# Copyright 1999-2014 Gentoo Foundation
+# Copyright 1999-2015 Gentoo Foundation
# Distributed under the terms of the GNU General Public License v2
# $Header: $
@@ -21,7 +21,9 @@
SRC_URI="http://www.nwchem-sw.org/images/Nwchem-${PV%_p*}.revision${PV#*_p}-src.
http://www.nwchem-sw.org/images/Makefile_gcc4x.patch.gz
http://www.nwchem-sw.org/images/Bcast_ccsd.patch.gz
http://www.nwchem-sw.org/images/Elpa_syncs.patch.gz
- http://www.nwchem-sw.org/images/Xlmpoles_ifort15.patch.gz";
+ http://www.nwchem-sw.org/images/Xlmpoles_ifort15.patch.gz
+ http://www.nwchem-sw.org/images/Ifort15_fpp_offload.patch.gz
+ http://www.nwchem-sw.org/images/Texas_iorb.patch.gz";
LICENSE="ECL-2.0"
SLOT="0"
@@ -107,7 +109,7 @@ src_unpack() {
src_prepare() {
pushd "${S}"/src
- for p in Util_md_sockets Hbar Tcenxtask Parallelmpi
Makefile_gcc4x Bcast_ccsd Elpa_syncs Xlmpoles_ifort15
+ for p in Util_md_sockets Hbar Tcenxtask Parallelmpi
Makefile_gcc4x Bcast_ccsd Elpa_syncs Xlmpoles_ifort15 Ifort15_fpp_offload
Texas_iorb
do epatch "${WORKDIR}"/"${p}.patch"
done
cd NWints/hondo
@@ -137,7 +139,6 @@ src_prepare() {
src_compile() {
export NWCHEM_LONG_PATHS=Y
- export USE_NOIO=TRUE
use openmp && export USE_OPENMP=1
export USE_MPI=y
export USE_MPIF=y
