-DIST tinker-7.1.2.tar.gz 28468683 SHA256 fdee18915cff9044fd083bb2271083c221db6d05de2cb98fc111b136e23e6899 SHA512 4524259754b0f11d7e2e8997ebd85eae7d28f8dbb1edb2d9818aa0a96640de0049aa4937236694f1a11743dee187d612f775b233a73cc96c2708d620457a7dc2 WHIRLPOOL f3e29eaf67d25ae6d4f3c4e3546798e66bd626929fddd45b9d1ff9f2143cd57dcc5079226f3ceaa142f4c6a168c4a150a51be1336a5ca13384338795ef3a6d46
+DIST tinker-8.2.1.tar.gz 33015410 BLAKE2B 0b7c94662248761459cf9d681056f5cf9c4d669a790a522f23f800bf355235f6a9f392e008b13d14cf1e17d9725abb6512077c24ff7772108d69c9cf35b43e6e SHA512 5039078781d1ce226456882dd95ad15715f1e91829d26efcdb29ceedc213973883699eb6710b0a162a74208809305b7fee734b175139e6df63d0460fe5751ae7
+++ /dev/null
-diff --git a/source/initial.f b/source/initial.f
-index 835f228..4099c74 100644
---- a/source/initial.f
-+++ b/source/initial.f
-@@ -73,8 +73,8 @@ c
- c
- c Intel compiler extensions to OpenMP standard
- c
--!$ call kmp_set_stacksize_s (2**28)
--!$ call kmp_set_blocktime (0)
-+! call kmp_set_stacksize_s (2**28)
-+! call kmp_set_blocktime (0)
- c
- c values of machine precision constants
- c
--- /dev/null
+ source/initial.f | 4 ++--
+ 1 file changed, 2 insertions(+), 2 deletions(-)
+
+diff --git a/source/initial.f b/source/initial.f
+index ff6ed54..9769a81 100644
+--- a/initial.f
++++ b/initial.f
+@@ -85,8 +85,8 @@ c
+ c Intel compiler extensions to OpenMP standard, 268435456 bytes is
+ c 2**28 bytes, or 256 MB; comment these lines for other compilers
+ c
+-c!$ call kmp_set_stacksize_s (268435456)
+-c!$ call kmp_set_blocktime (0)
++!$ call kmp_set_stacksize_s (268435456)
++!$ call kmp_set_blocktime (0)
+ c
+ c values of machine precision constants
+ c
+++ /dev/null
- make/Makefile | 3 +--
- 1 file changed, 1 insertion(+), 2 deletions(-)
-
-diff --git a/make/Makefile b/make/Makefile
-index 61d5037..9be384a 100644
---- a/make/Makefile
-+++ b/make/Makefile
-@@ -719,8 +719,7 @@ EXEFILES = alchemy.x \
- %.x: %.o libtinker.a
- ${F77} ${LINKFLAGS} -o $@ $^ ${LIBS}; strip $@
-
--all:
-- ${EXEFILES}
-+all: ${EXEFILES}
-
- install:
- rename
# Copyright 1999-2017 Gentoo Foundation
# Distributed under the terms of the GNU General Public License v2
-EAPI=5
+EAPI=6
inherit eutils flag-o-matic fortran-2 java-pkg-opt-2 toolchain-funcs
}
src_prepare() {
- sed 's:strip:true:g' -i ../make/Makefile
- [[ $(tc-getFC) =~ "ifort" ]] || epatch "${FILESDIR}"/${PV}-openmp.patch
- cd .. && epatch "${FILESDIR}"/${P}-build.patch
+ sed 's:strip:true:g' -i ../make/Makefile || die
+ [[ $(tc-getFC) =~ "ifort" ]] && eapply "${FILESDIR}"/${PV}-openmp.patch
+ default
}
src_compile() {
emake \
-f ../make/Makefile \
BINDIR="${S}"/../bin \
- rename
+ rename_bin
}
src_test() {