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science/tinker: Update 8.10.1 -> 8.10.2
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Reported by:	portscout
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yurivict committed Apr 14, 2022
1 parent eebcc07 commit 141e15d
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Showing 4 changed files with 9 additions and 21 deletions.
4 changes: 3 additions & 1 deletion science/tinker/Makefile
@@ -1,7 +1,7 @@
# Created by: Glenn Johnson

PORTNAME= tinker
DISTVERSION= 8.10.1
DISTVERSION= 8.10.2
CATEGORIES= science
MASTER_SITES= https://dasher.wustl.edu/tinker/downloads/

Expand Down Expand Up @@ -56,6 +56,8 @@ FFLAGS+= -mfancy-math-387 -malign-double
post-extract:
@${RM} ${BUILD_WRKSRC}/*.c
@${RM} ${WRKSRC}/other/eopbend.orig
# remove bundled linux libraries
@${RM} ${WRKSRC}/lib/linux/*

post-patch:
@${REINPLACE_CMD} -i '' 's|\.\./bin/|${STAGEDIR}${PREFIX}/bin/|' ${BUILD_WRKSRC}/../bench/bench*.run
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6 changes: 3 additions & 3 deletions science/tinker/distinfo
@@ -1,3 +1,3 @@
TIMESTAMP = 1633966955
SHA256 (tinker-8.10.1.tar.gz) = 4687d60cc44c83462a15639920c4a7fe551aec6b41f295c93962d83bf4ef4f2b
SIZE (tinker-8.10.1.tar.gz) = 65197637
TIMESTAMP = 1649951980
SHA256 (tinker-8.10.2.tar.gz) = 7481769f3d61f81ab98e6a0950520693a6d078c4048998f388efb72c20adde40
SIZE (tinker-8.10.2.tar.gz) = 72009856
14 changes: 1 addition & 13 deletions science/tinker/files/patch-make_Makefile
@@ -1,17 +1,5 @@
--- make/Makefile.orig 2021-09-29 02:42:24 UTC
--- make/Makefile.orig 2022-01-13 23:40:10 UTC
+++ make/Makefile
@@ -87,9 +87,9 @@ APBS_LIBS = -lapbsmainroutines -lapbs -lmaloc -lapbsbl
F77 = gfortran
F77FLAGS = -c
#OPTFLAGS = -Ofast -march=native -fopenmp
-OPTFLAGS = -Ofast -mssse3 -fopenmp
+OPTFLAGS = -Ofast $(PORT_SIMD_FLAGS) -fopenmp
#OPTFLAGS = -Og -fbacktrace -fcheck=bounds -Wunused -Wmaybe-uninitialized
-LIBDIR = -L. -L$(TINKER_LIBDIR)/macos
+#LIBDIR = -L. -L$(TINKER_LIBDIR)/macos
LIBS =
LIBFLAGS = -crusv
RANLIB = ranlib -c
@@ -803,136 +803,136 @@ listing:
cat *.f *.c > tinker.txt

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6 changes: 2 additions & 4 deletions science/tinker/pkg-plist
Expand Up @@ -63,7 +63,6 @@ bin/xyzint
bin/xyzmol2
bin/xyzpdb
%%DATADIR%%/params/0README
%%DATADIR%%/params/amber14sb.prm
%%DATADIR%%/params/amber94.prm
%%DATADIR%%/params/amber96.prm
%%DATADIR%%/params/amber98.prm
Expand All @@ -82,7 +81,6 @@ bin/xyzpdb
%%DATADIR%%/params/charmm22.prm
%%DATADIR%%/params/charmm22cmap.prm
%%DATADIR%%/params/dang.prm
%%DATADIR%%/params/hippo19.prm
%%DATADIR%%/params/hoch.prm
%%DATADIR%%/params/iwater.prm
%%DATADIR%%/params/mm2.prm
Expand All @@ -91,7 +89,6 @@ bin/xyzpdb
%%DATADIR%%/params/mmff.prm
%%DATADIR%%/params/oplsaa.prm
%%DATADIR%%/params/oplsaal.prm
%%DATADIR%%/params/oplsaam.prm
%%DATADIR%%/params/oplsua.prm
%%DATADIR%%/params/smoothaa.prm
%%DATADIR%%/params/smoothua.prm
Expand Down Expand Up @@ -201,7 +198,8 @@ bin/xyzpdb
%%DATADIR%%/test/salt.key
%%DATADIR%%/test/salt.log
%%DATADIR%%/test/salt.run
%%DATADIR%%/test/water.key
%%DATADIR%%/test/water.amoeba
%%DATADIR%%/test/water.hippo
%%DATADIR%%/test/water.log
%%DATADIR%%/test/water.pot
%%DATADIR%%/test/water.run
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