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authorThierry Thomas <thierry@FreeBSD.org>2004-08-19 22:24:21 +0000
committerThierry Thomas <thierry@FreeBSD.org>2004-08-19 22:24:21 +0000
commit33975deea1108576eb0a8a2c2bf8e3b1ba42ac63 (patch)
treea9de4aa0f80798eea1825721cbbd740d0820923c /biology
parent2fc1597f2b3e4cf7096b8afa53c6cb5b5597f187 (diff)
downloadports-33975deea1108576eb0a8a2c2bf8e3b1ba42ac63.tar.gz
ports-33975deea1108576eb0a8a2c2bf8e3b1ba42ac63.zip
- Unbreak by upgrading to 4.2;
- Use DIST_SUBDIR because tarball is not versioned; - Add sysdate to PORTVERSION to handle minor revisions; - Do some cleaning.
Notes
Notes: svn path=/head/; revision=116727
Diffstat (limited to 'biology')
-rw-r--r--biology/tinker/Makefile102
-rw-r--r--biology/tinker/distinfo3
-rw-r--r--biology/tinker/files/patch-aa29
-rw-r--r--biology/tinker/pkg-plist697
4 files changed, 387 insertions, 444 deletions
diff --git a/biology/tinker/Makefile b/biology/tinker/Makefile
index aaafaf3a2f4f..d344589f45a3 100644
--- a/biology/tinker/Makefile
+++ b/biology/tinker/Makefile
@@ -6,18 +6,17 @@
#
PORTNAME= tinker
-PORTVERSION= 4.1
+PORTVERSION= 4.2.20040819
CATEGORIES= biology
MASTER_SITES= ftp://dasher.wustl.edu/pub/
DISTNAME= ${PORTNAME}
+DIST_SUBDIR= ${PORTNAME}-${PORTVERSION}
MAINTAINER= ports@FreeBSD.org
COMMENT= A general purpose molecular modelling package
BUILD_DEPENDS= imake:${X_IMAKE_PORT}
-BROKEN= Distfile has been updated to version 4.2. Port needs update
-
MAKE_ENV+= HAVE_G2C=yes INSTALL_PROGRAM="${INSTALL_PROGRAM}"
WRKSRC= ${WRKDIR}/tinker/source
@@ -28,13 +27,20 @@ INSTALL_TARGET= rename
USE_REINPLACE= yes
RESTRICTED= author requests no distribution except from his FTP site
-pre-fetch:
- @${ECHO_MSG} ""
- @${ECHO_MSG} If you get a CHECKSUM mismatch, try doing a \'make distclean\' first.
- @${ECHO_MSG} ""
+DOCS= README *.pdf *.txt release*
+SAMPLES= README clean.make *.1st *.boat *.cell *.chair *.dat *.dyn0 \
+ *.key *.log *.pdb *.run *.xyz
+BENCHES= README *.dyn0 *.log *.key *.run *.xyz results*
.include <bsd.port.pre.mk>
+.if defined(WITH_OPTIMIZED_FLAGS)
+FFLAGS+= -O3 -ffast-math -finline-functions -fomit-frame-pointer -funroll-loops -fexpensive-optimizations
+.if (${ARCH} == "i386")
+FFLAGS+= -mfancy-math-387 -malign-double
+.endif # i386
+.endif
+
.if defined(WITH_VIEWER)
USE_XLIB= yes
PLIST_SUB+= WITH_VIEWER=""
@@ -49,12 +55,6 @@ pre-extract:
@${ECHO_MSG} ""
.endif
-.if defined(WITH_OPTIMIZED_FLAGS)
-FFLAGS+= -O3 -ffast-math -finline-functions -fomit-frame-pointer -funroll-loops -fexpensive-optimizations
-.if (${MACHINE_ARCH} == "i386")
-FFLAGS+= -mfancy-math-387 -malign-double
-.endif # i386
-.endif
pre-everything::
.if !defined(WITH_OPTIMIZED_FLAGS)
@${ECHO_MSG} "You can optimize by setting WITH_OPTIMIZED_FLAGS=yes."
@@ -67,82 +67,34 @@ post-patch:
@${REINPLACE_CMD} -e 's,%%FFLAGS%%,${FFLAGS},g' ${WRKSRC}/../make/Makefile
post-install:
- @${MKDIR} ${PREFIX}/share/tinker
- @${MKDIR} ${PREFIX}/share/tinker/params
+ @${MKDIR} ${DATADIR}/params
@${INSTALL_DATA} ${WRKDIR}/tinker/source/tinker.txt \
-${PREFIX}/share/tinker
+ ${DATADIR}
@${INSTALL_DATA} ${WRKDIR}/tinker/params/* \
-${PREFIX}/share/tinker/params
-
+ ${DATADIR}/params
.if !defined(NOPORTDOCS)
- @${MKDIR} ${PREFIX}/share/doc/tinker
- @${MKDIR} ${PREFIX}/share/examples/tinker
- @${MKDIR} ${PREFIX}/share/tinker/bench
- @${MKDIR} ${PREFIX}/share/tinker/test
- @${INSTALL_DATA} ${WRKDIR}/tinker/doc/README \
-${PREFIX}/share/doc/tinker
- @${INSTALL_DATA} ${WRKDIR}/tinker/doc/*.pdf \
-${PREFIX}/share/doc/tinker
- @${INSTALL_DATA} ${WRKDIR}/tinker/doc/*.txt \
-${PREFIX}/share/doc/tinker
- @${INSTALL_DATA} ${WRKDIR}/tinker/doc/release* \
-${PREFIX}/share/doc/tinker
- @${INSTALL_DATA} ${WRKDIR}/tinker/example/README \
-${PREFIX}/share/examples/tinker
- @${INSTALL_SCRIPT} ${WRKDIR}/tinker/example/clean.make \
-${PREFIX}/share/examples/tinker
- @${INSTALL_DATA} ${WRKDIR}/tinker/example/*.1st \
-${PREFIX}/share/examples/tinker
- @${INSTALL_DATA} ${WRKDIR}/tinker/example/*.boat \
-${PREFIX}/share/examples/tinker
- @${INSTALL_DATA} ${WRKDIR}/tinker/example/*.cell \
-${PREFIX}/share/examples/tinker
- @${INSTALL_DATA} ${WRKDIR}/tinker/example/*.chair \
-${PREFIX}/share/examples/tinker
- @${INSTALL_DATA} ${WRKDIR}/tinker/example/*.dat \
-${PREFIX}/share/examples/tinker
- @${INSTALL_DATA} ${WRKDIR}/tinker/example/*.dyn0 \
-${PREFIX}/share/examples/tinker
- @${INSTALL_DATA} ${WRKDIR}/tinker/example/*.key \
-${PREFIX}/share/examples/tinker
- @${INSTALL_DATA} ${WRKDIR}/tinker/example/*.log \
-${PREFIX}/share/examples/tinker
- @${INSTALL_DATA} ${WRKDIR}/tinker/example/*.pdb \
-${PREFIX}/share/examples/tinker
- @${INSTALL_DATA} ${WRKDIR}/tinker/example/*.xyz \
-${PREFIX}/share/examples/tinker
- @${INSTALL_SCRIPT} ${WRKDIR}/tinker/example/*.run \
-${PREFIX}/share/examples/tinker
- @${INSTALL_DATA} ${WRKDIR}/tinker/bench/README \
-${PREFIX}/share/tinker/bench
- @${INSTALL_DATA} ${WRKDIR}/tinker/bench/*.dyn0 \
-${PREFIX}/share/tinker/bench
- @${INSTALL_DATA} ${WRKDIR}/tinker/bench/*.log \
-${PREFIX}/share/tinker/bench
- @${INSTALL_DATA} ${WRKDIR}/tinker/bench/*.key \
-${PREFIX}/share/tinker/bench
- @${INSTALL_SCRIPT} ${WRKDIR}/tinker/bench/*.run \
-${PREFIX}/share/tinker/bench
- @${INSTALL_DATA} ${WRKDIR}/tinker/bench/*.xyz \
-${PREFIX}/share/tinker/bench
- @${INSTALL_DATA} ${WRKDIR}/tinker/bench/results* \
-${PREFIX}/share/tinker/bench
- @${INSTALL_DATA} ${WRKDIR}/tinker/test/* ${PREFIX}/share/tinker/test
+ @${MKDIR} ${DOCSDIR}
+ @${MKDIR} ${EXAMPLESDIR}
+ @${MKDIR} ${DATADIR}/bench
+ @${MKDIR} ${DATADIR}/test
+ @${INSTALL_DATA} ${DOCS:S|^|${WRKDIR}/tinker/doc/|} ${DOCSDIR}
+ @${INSTALL_DATA} ${SAMPLES:S|^|${WRKDIR}/tinker/example/|} ${EXAMPLESDIR}
+ @${INSTALL_DATA} ${BENCHES:S|^|${WRKDIR}/tinker/bench/|} ${DATADIR}/bench
+ @${INSTALL_DATA} ${WRKDIR}/tinker/test/* ${DATADIR}/test
.endif
-
.if defined(WITH_VIEWER)
- @${MKDIR} ${PREFIX}/share/tinker/rasmol
+ @${MKDIR} ${DATADIR}/rasmol
@${INSTALL_PROGRAM} ${WRKDIR}/tinker/rasmol/tview-* ${PREFIX}/bin
@${INSTALL_SCRIPT} ${FILESDIR}/tview ${PREFIX}/bin
@${INSTALL_DATA} ${WRKDIR}/tinker/rasmol/rasmol.hlp \
- ${PREFIX}/share/tinker/rasmol
+ ${DATADIR}/rasmol
.endif
@${ECHO_MSG} ""
@${ECHO_MSG} " **********************************************************"
@${ECHO_MSG} " The author requests that you return a license form "
@${ECHO_MSG} " to him if you find Tinker to be useful. "
@${ECHO_MSG} " "
- @${ECHO_MSG} " See ${PREFIX}/share/doc/tinker for license forms. "
+ @${ECHO_MSG} " See ${DOCSDIR} for license forms. "
@${ECHO_MSG} " **********************************************************"
@${ECHO_MSG} ""
diff --git a/biology/tinker/distinfo b/biology/tinker/distinfo
index 9f464b07bcfd..84a9c240921c 100644
--- a/biology/tinker/distinfo
+++ b/biology/tinker/distinfo
@@ -1 +1,2 @@
-MD5 (tinker.tar.gz) = 5d02d9ae2964b232b2edcbd5ef3c478e
+MD5 (tinker-4.2.20040819/tinker.tar.gz) = ac4d54ee05451bac3ed1ce51b27087bf
+SIZE (tinker-4.2.20040819/tinker.tar.gz) = 8177366
diff --git a/biology/tinker/files/patch-aa b/biology/tinker/files/patch-aa
index f115ed7936b5..3ac9a9e15f8a 100644
--- a/biology/tinker/files/patch-aa
+++ b/biology/tinker/files/patch-aa
@@ -1,5 +1,5 @@
---- ../make/Makefile.orig Sat Apr 19 03:32:36 2003
-+++ ../make/Makefile Fri Jul 25 11:33:40 2003
+--- ../make/Makefile.orig Thu Aug 19 17:37:44 2004
++++ ../make/Makefile Thu Aug 19 22:52:41 2004
@@ -9,8 +9,8 @@
##
## 1. make all Build all the TINKER executables
@@ -24,25 +24,6 @@
####################################################################
## Known Machine Types; Uncomment One of the Following Sections ##
-@@ -101,12 +101,12 @@
- ## Compiler: Intel Fortran
- ##
-
--F77 = /usr/intel/compiler70/ia32/bin/ifc
--LIBS =
--F77FLAGS = -c
--OPTFLAGS = -O2 -cm -w
--LIBFLAGS = -crusv
--LINKFLAGS = -Vaxlib
-+#F77 = /usr/intel/compiler70/ia32/bin/ifc
-+#LIBS =
-+#F77FLAGS = -c
-+#OPTFLAGS = -O2 -cm -w
-+#LIBFLAGS = -crusv
-+#LINKFLAGS = -Vaxlib
-
- ##
- ## Machine: IntelPC / Linux
@@ -122,6 +122,20 @@
#LIBFLAGS = -crusv
#LINKFLAGS =
@@ -64,7 +45,7 @@
#################################################################
## Should not be Necessary to Change Things Below this Point ##
#################################################################
-@@ -522,11 +536,13 @@
+@@ -529,11 +543,13 @@
xyzpdb.x \
xyzsybyl.x
@@ -80,7 +61,7 @@
all: ${EXEFILES}
-@@ -537,58 +553,58 @@
+@@ -544,59 +560,59 @@
cat *.i *.f > tinker.txt
rename:
@@ -110,6 +91,7 @@
- mv path.x $(BINDIR)/path
- mv pdbxyz.x $(BINDIR)/pdbxyz
- mv polarize.x $(BINDIR)/polarize
+- mv prmedit.x $(BINDIR)/prmedit
- mv protein.x $(BINDIR)/protein
- mv pss.x $(BINDIR)/pss
- mv pssrigid.x $(BINDIR)/pssrigid
@@ -162,6 +144,7 @@
+ ${INSTALL_PROGRAM} path.x $(BINDIR)/path
+ ${INSTALL_PROGRAM} pdbxyz.x $(BINDIR)/pdbxyz
+ ${INSTALL_PROGRAM} polarize.x $(BINDIR)/polarize
++ ${INSTALL_PROGRAM} prmedit.x $(BINDIR)/prmedit
+ ${INSTALL_PROGRAM} protein.x $(BINDIR)/protein
+ ${INSTALL_PROGRAM} pss.x $(BINDIR)/pss
+ ${INSTALL_PROGRAM} pssrigid.x $(BINDIR)/pssrigid
diff --git a/biology/tinker/pkg-plist b/biology/tinker/pkg-plist
index b7d3ffb5ca15..f9e728d8df1c 100644
--- a/biology/tinker/pkg-plist
+++ b/biology/tinker/pkg-plist
@@ -24,6 +24,7 @@ bin/optrigid
bin/path
bin/pdbxyz
bin/polarize
+bin/prmedit
bin/protein
bin/pss
bin/pssrigid
@@ -55,6 +56,7 @@ bin/xyzint
bin/xyzpdb
bin/xyzsybyl
%%PORTDOCS%%%%DOCSDIR%%/README
+%%PORTDOCS%%%%DOCSDIR%%/ffe-guide.pdf
%%PORTDOCS%%%%DOCSDIR%%/guide.pdf
%%PORTDOCS%%%%DOCSDIR%%/guide.txt
%%PORTDOCS%%%%DOCSDIR%%/license.pdf
@@ -66,6 +68,7 @@ bin/xyzsybyl
%%PORTDOCS%%%%DOCSDIR%%/release-3.9
%%PORTDOCS%%%%DOCSDIR%%/release-4.0
%%PORTDOCS%%%%DOCSDIR%%/release-4.1
+%%PORTDOCS%%%%DOCSDIR%%/release-4.2
%%PORTDOCS%%%%DOCSDIR%%/summary.pdf
%%PORTDOCS%%%%DOCSDIR%%/summary.txt
%%PORTDOCS%%share/examples/tinker/README
@@ -115,350 +118,354 @@ bin/xyzsybyl
%%PORTDOCS%%share/examples/tinker/salt.key
%%PORTDOCS%%share/examples/tinker/salt.log
%%PORTDOCS%%share/examples/tinker/salt.run
-%%PORTDOCS%%share/tinker/bench/README
-%%PORTDOCS%%share/tinker/bench/bench1.key
-%%PORTDOCS%%share/tinker/bench/bench1.run
-%%PORTDOCS%%share/tinker/bench/bench1.xyz
-%%PORTDOCS%%share/tinker/bench/bench2.key
-%%PORTDOCS%%share/tinker/bench/bench2.run
-%%PORTDOCS%%share/tinker/bench/bench2.xyz
-%%PORTDOCS%%share/tinker/bench/bench3.key
-%%PORTDOCS%%share/tinker/bench/bench3.run
-%%PORTDOCS%%share/tinker/bench/bench3.xyz
-%%PORTDOCS%%share/tinker/bench/bench4.dyn0
-%%PORTDOCS%%share/tinker/bench/bench4.key
-%%PORTDOCS%%share/tinker/bench/bench4.log
-%%PORTDOCS%%share/tinker/bench/bench4.run
-%%PORTDOCS%%share/tinker/bench/bench4.xyz
-%%PORTDOCS%%share/tinker/bench/bench5.dyn0
-%%PORTDOCS%%share/tinker/bench/bench5.key
-%%PORTDOCS%%share/tinker/bench/bench5.log
-%%PORTDOCS%%share/tinker/bench/bench5.run
-%%PORTDOCS%%share/tinker/bench/bench5.xyz
-%%PORTDOCS%%share/tinker/bench/results-2.3
-%%PORTDOCS%%share/tinker/bench/results-2.4
-%%PORTDOCS%%share/tinker/bench/results-2.9
-%%PORTDOCS%%share/tinker/bench/results-3.1
-%%PORTDOCS%%share/tinker/bench/results-3.2
-%%PORTDOCS%%share/tinker/bench/results-3.4
-%%PORTDOCS%%share/tinker/bench/results-3.5
-%%PORTDOCS%%share/tinker/bench/results-3.7
-%%PORTDOCS%%share/tinker/bench/results-3.8
-%%PORTDOCS%%share/tinker/bench/results-3.9
-%%PORTDOCS%%share/tinker/bench/results-4.0
-%%PORTDOCS%%share/tinker/bench/results-4.1
-share/tinker/params/README
-share/tinker/params/amber94.prm
-share/tinker/params/amber96.prm
-share/tinker/params/amber98.prm
-share/tinker/params/amber99.prm
-share/tinker/params/amoeba.prm
-share/tinker/params/charmm19.prm
-share/tinker/params/charmm27.prm
-share/tinker/params/dudek.prm
-share/tinker/params/hoch.prm
-share/tinker/params/mm2.prm
-share/tinker/params/mm3.prm
-share/tinker/params/mm3pro.prm
-share/tinker/params/oplsaa.prm
-share/tinker/params/oplsaal.prm
-share/tinker/params/oplsua.prm
-share/tinker/params/smooth.prm
-share/tinker/params/smoothaa.prm
-share/tinker/params/water.prm
-%%WITH_VIEWER%%share/tinker/rasmol/rasmol.hlp
-%%PORTDOCS%%share/tinker/test/README
-%%PORTDOCS%%share/tinker/test/alkane.key
-%%PORTDOCS%%share/tinker/test/alkane.xyz
-%%PORTDOCS%%share/tinker/test/amoeba.key
-%%PORTDOCS%%share/tinker/test/amoeba.xyz
-%%PORTDOCS%%share/tinker/test/arach.int
-%%PORTDOCS%%share/tinker/test/arach.key
-%%PORTDOCS%%share/tinker/test/arach.xyz
-%%PORTDOCS%%share/tinker/test/azulene.int
-%%PORTDOCS%%share/tinker/test/azulene.key
-%%PORTDOCS%%share/tinker/test/azulene.xyz
-%%PORTDOCS%%share/tinker/test/bdna.int
-%%PORTDOCS%%share/tinker/test/bdna.key
-%%PORTDOCS%%share/tinker/test/bdna.make
-%%PORTDOCS%%share/tinker/test/bdna.seq
-%%PORTDOCS%%share/tinker/test/bdna.xyz
-%%PORTDOCS%%share/tinker/test/bearing.key
-%%PORTDOCS%%share/tinker/test/bearing.xyz
-%%PORTDOCS%%share/tinker/test/bearing2.key
-%%PORTDOCS%%share/tinker/test/bearing2.xyz
-%%PORTDOCS%%share/tinker/test/benzene.int
-%%PORTDOCS%%share/tinker/test/benzene.key
-%%PORTDOCS%%share/tinker/test/benzene.xyz
-%%PORTDOCS%%share/tinker/test/bowl.int
-%%PORTDOCS%%share/tinker/test/bowl.key
-%%PORTDOCS%%share/tinker/test/bowl.xyz
-%%PORTDOCS%%share/tinker/test/bowl2.key
-%%PORTDOCS%%share/tinker/test/bowl2.xyz
-%%PORTDOCS%%share/tinker/test/bowl3.key
-%%PORTDOCS%%share/tinker/test/bowl3.xyz
-%%PORTDOCS%%share/tinker/test/bucky.int
-%%PORTDOCS%%share/tinker/test/bucky.key
-%%PORTDOCS%%share/tinker/test/bucky.xyz
-%%PORTDOCS%%share/tinker/test/butane.int
-%%PORTDOCS%%share/tinker/test/butane.key
-%%PORTDOCS%%share/tinker/test/butane.xyz
-%%PORTDOCS%%share/tinker/test/butane2.int
-%%PORTDOCS%%share/tinker/test/butane2.key
-%%PORTDOCS%%share/tinker/test/butane2.xyz
-%%PORTDOCS%%share/tinker/test/butanes.dyn
-%%PORTDOCS%%share/tinker/test/butanes.key
-%%PORTDOCS%%share/tinker/test/butanes.xyz
-%%PORTDOCS%%share/tinker/test/butanex.key
-%%PORTDOCS%%share/tinker/test/butanex.xyz
-%%PORTDOCS%%share/tinker/test/butopls.int
-%%PORTDOCS%%share/tinker/test/butopls.key
-%%PORTDOCS%%share/tinker/test/butopls.xyz
-%%PORTDOCS%%share/tinker/test/butopls2.int
-%%PORTDOCS%%share/tinker/test/butopls2.key
-%%PORTDOCS%%share/tinker/test/butopls2.xyz
-%%PORTDOCS%%share/tinker/test/c5.key
-%%PORTDOCS%%share/tinker/test/c5.seq
-%%PORTDOCS%%share/tinker/test/c5.xyz
-%%PORTDOCS%%share/tinker/test/c7a.key
-%%PORTDOCS%%share/tinker/test/c7a.seq
-%%PORTDOCS%%share/tinker/test/c7a.xyz
-%%PORTDOCS%%share/tinker/test/c7e.key
-%%PORTDOCS%%share/tinker/test/c7e.seq
-%%PORTDOCS%%share/tinker/test/c7e.xyz
-%%PORTDOCS%%share/tinker/test/calmodulin.key
-%%PORTDOCS%%share/tinker/test/calmodulin.pdb
-%%PORTDOCS%%share/tinker/test/calmodulin.seq
-%%PORTDOCS%%share/tinker/test/calmodulin.xyz
-%%PORTDOCS%%share/tinker/test/copper.key
-%%PORTDOCS%%share/tinker/test/copper.xyz
-%%PORTDOCS%%share/tinker/test/cpentene.key
-%%PORTDOCS%%share/tinker/test/cpentene.xyz
-%%PORTDOCS%%share/tinker/test/crambin.key
-%%PORTDOCS%%share/tinker/test/crambin.pdb
-%%PORTDOCS%%share/tinker/test/crambin.seq
-%%PORTDOCS%%share/tinker/test/crambin.xyz
-%%PORTDOCS%%share/tinker/test/crambinx.key
-%%PORTDOCS%%share/tinker/test/crambinx.ray
-%%PORTDOCS%%share/tinker/test/crambinx.xyz
-%%PORTDOCS%%share/tinker/test/crown.int
-%%PORTDOCS%%share/tinker/test/crown.key
-%%PORTDOCS%%share/tinker/test/crown.xyz
-%%PORTDOCS%%share/tinker/test/cychept.int
-%%PORTDOCS%%share/tinker/test/cychept.key
-%%PORTDOCS%%share/tinker/test/cychept.xyz
-%%PORTDOCS%%share/tinker/test/cyclo.int
-%%PORTDOCS%%share/tinker/test/cyclo.key
-%%PORTDOCS%%share/tinker/test/cyclo.xyz
-%%PORTDOCS%%share/tinker/test/cyclo2.int
-%%PORTDOCS%%share/tinker/test/cyclo2.key
-%%PORTDOCS%%share/tinker/test/cyclo2.xyz
-%%PORTDOCS%%share/tinker/test/dang.key
-%%PORTDOCS%%share/tinker/test/dang.xyz
-%%PORTDOCS%%share/tinker/test/diamond.key
-%%PORTDOCS%%share/tinker/test/diamond.xyz
-%%PORTDOCS%%share/tinker/test/diene.int
-%%PORTDOCS%%share/tinker/test/diene.key
-%%PORTDOCS%%share/tinker/test/diene.xyz
-%%PORTDOCS%%share/tinker/test/dimethane.key
-%%PORTDOCS%%share/tinker/test/dimethane.xyz
-%%PORTDOCS%%share/tinker/test/enkephalin.int
-%%PORTDOCS%%share/tinker/test/enkephalin.key
-%%PORTDOCS%%share/tinker/test/enkephalin.make
-%%PORTDOCS%%share/tinker/test/enkephalin.seq
-%%PORTDOCS%%share/tinker/test/enkephalin.xyz
-%%PORTDOCS%%share/tinker/test/ermer.int
-%%PORTDOCS%%share/tinker/test/ermer.key
-%%PORTDOCS%%share/tinker/test/ermer.xyz
-%%PORTDOCS%%share/tinker/test/ester.key
-%%PORTDOCS%%share/tinker/test/ester.xyz
-%%PORTDOCS%%share/tinker/test/ethane.int
-%%PORTDOCS%%share/tinker/test/ethane.key
-%%PORTDOCS%%share/tinker/test/ethane.xyz
-%%PORTDOCS%%share/tinker/test/ethanol.int
-%%PORTDOCS%%share/tinker/test/ethanol.key
-%%PORTDOCS%%share/tinker/test/ethanol.xyz
-%%PORTDOCS%%share/tinker/test/ethylene.int
-%%PORTDOCS%%share/tinker/test/ethylene.key
-%%PORTDOCS%%share/tinker/test/ethylene.xyz
-%%PORTDOCS%%share/tinker/test/flane.int
-%%PORTDOCS%%share/tinker/test/flane.key
-%%PORTDOCS%%share/tinker/test/flane.xyz
-%%PORTDOCS%%share/tinker/test/form.key
-%%PORTDOCS%%share/tinker/test/form.xyz
-%%PORTDOCS%%share/tinker/test/formbig.key
-%%PORTDOCS%%share/tinker/test/formbig.xyz
-%%PORTDOCS%%share/tinker/test/formbox.dyn
-%%PORTDOCS%%share/tinker/test/formbox.key
-%%PORTDOCS%%share/tinker/test/formbox.xyz
-%%PORTDOCS%%share/tinker/test/furan.int
-%%PORTDOCS%%share/tinker/test/furan.key
-%%PORTDOCS%%share/tinker/test/furan.xyz
-%%PORTDOCS%%share/tinker/test/glucose.key
-%%PORTDOCS%%share/tinker/test/glucose.xyz
-%%PORTDOCS%%share/tinker/test/glycerol.dyn
-%%PORTDOCS%%share/tinker/test/glycerol.key
-%%PORTDOCS%%share/tinker/test/glycerol.xyz
-%%PORTDOCS%%share/tinker/test/graphite.key
-%%PORTDOCS%%share/tinker/test/graphite.xyz
-%%PORTDOCS%%share/tinker/test/helix.dyn
-%%PORTDOCS%%share/tinker/test/helix.key
-%%PORTDOCS%%share/tinker/test/helix.xyz
-%%PORTDOCS%%share/tinker/test/heme.key
-%%PORTDOCS%%share/tinker/test/heme.xyz
-%%PORTDOCS%%share/tinker/test/hexane.int
-%%PORTDOCS%%share/tinker/test/hexane.key
-%%PORTDOCS%%share/tinker/test/hexane.xyz
-%%PORTDOCS%%share/tinker/test/hexanes.dyn
-%%PORTDOCS%%share/tinker/test/hexanes.key
-%%PORTDOCS%%share/tinker/test/hexanes.run
-%%PORTDOCS%%share/tinker/test/hexanes.xyz
-%%PORTDOCS%%share/tinker/test/imidazole.int
-%%PORTDOCS%%share/tinker/test/imidazole.key
-%%PORTDOCS%%share/tinker/test/imidazole.xyz
-%%PORTDOCS%%share/tinker/test/imine.int
-%%PORTDOCS%%share/tinker/test/imine.key
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+%%PORTDOCS%%%%DATADIR%%/test/skunk.xyz
+%%PORTDOCS%%%%DATADIR%%/test/spc.key
+%%PORTDOCS%%%%DATADIR%%/test/spc.xyz
+%%PORTDOCS%%%%DATADIR%%/test/sterol.key
+%%PORTDOCS%%%%DATADIR%%/test/sterol.xyz
+%%PORTDOCS%%%%DATADIR%%/test/styrene.int
+%%PORTDOCS%%%%DATADIR%%/test/styrene.key
+%%PORTDOCS%%%%DATADIR%%/test/styrene.xyz
+%%PORTDOCS%%%%DATADIR%%/test/terphenyl.key
+%%PORTDOCS%%%%DATADIR%%/test/terphenyl.xyz
+%%PORTDOCS%%%%DATADIR%%/test/tfe.key
+%%PORTDOCS%%%%DATADIR%%/test/tfe.xyz
+%%PORTDOCS%%%%DATADIR%%/test/thiadiene.int
+%%PORTDOCS%%%%DATADIR%%/test/thiadiene.key
+%%PORTDOCS%%%%DATADIR%%/test/thiadiene.xyz
+%%PORTDOCS%%%%DATADIR%%/test/thiophene.int
+%%PORTDOCS%%%%DATADIR%%/test/thiophene.key
+%%PORTDOCS%%%%DATADIR%%/test/thiophene.xyz
+%%PORTDOCS%%%%DATADIR%%/test/thr.int
+%%PORTDOCS%%%%DATADIR%%/test/thr.key
+%%PORTDOCS%%%%DATADIR%%/test/thr.xyz
+%%PORTDOCS%%%%DATADIR%%/test/tip3f.key
+%%PORTDOCS%%%%DATADIR%%/test/tip3f.xyz
+%%PORTDOCS%%%%DATADIR%%/test/tip3p.key
+%%PORTDOCS%%%%DATADIR%%/test/tip3p.xyz
+%%PORTDOCS%%%%DATADIR%%/test/tip4f.key
+%%PORTDOCS%%%%DATADIR%%/test/tip4f.xyz
+%%PORTDOCS%%%%DATADIR%%/test/tip4p.key
+%%PORTDOCS%%%%DATADIR%%/test/tip4p.xyz
+%%PORTDOCS%%%%DATADIR%%/test/tip5p.key
+%%PORTDOCS%%%%DATADIR%%/test/tip5p.xyz
+%%PORTDOCS%%%%DATADIR%%/test/trpcage.key
+%%PORTDOCS%%%%DATADIR%%/test/trpcage.pdb
+%%PORTDOCS%%%%DATADIR%%/test/trpcage.seq
+%%PORTDOCS%%%%DATADIR%%/test/trpcage.xyz
+%%PORTDOCS%%%%DATADIR%%/test/water.int
+%%PORTDOCS%%%%DATADIR%%/test/water.key
+%%PORTDOCS%%%%DATADIR%%/test/water.xyz
+%%PORTDOCS%%%%DATADIR%%/test/waterbig.key
+%%PORTDOCS%%%%DATADIR%%/test/waterbig.xyz
+%%PORTDOCS%%%%DATADIR%%/test/waterbox.dyn
+%%PORTDOCS%%%%DATADIR%%/test/waterbox.key
+%%PORTDOCS%%%%DATADIR%%/test/waterbox.xyz
+%%PORTDOCS%%%%DATADIR%%/test/waterdot.dyn
+%%PORTDOCS%%%%DATADIR%%/test/waterdot.key
+%%PORTDOCS%%%%DATADIR%%/test/waterdot.xyz
+%%PORTDOCS%%%%DATADIR%%/test/waterhuge.key
+%%PORTDOCS%%%%DATADIR%%/test/waterhuge.xyz
+%%PORTDOCS%%%%DATADIR%%/test/watersmall.dyn
+%%PORTDOCS%%%%DATADIR%%/test/watersmall.key
+%%PORTDOCS%%%%DATADIR%%/test/watersmall.xyz
+%%PORTDOCS%%%%DATADIR%%/test/watertiny.dyn
+%%PORTDOCS%%%%DATADIR%%/test/watertiny.key
+%%PORTDOCS%%%%DATADIR%%/test/watertiny.xyz
+%%PORTDOCS%%%%DATADIR%%/test/white.int
+%%PORTDOCS%%%%DATADIR%%/test/white.key
+%%PORTDOCS%%%%DATADIR%%/test/white.xyz
+%%DATADIR%%/tinker.txt
%%PORTDOCS%%@dirrm %%DOCSDIR%%
%%PORTDOCS%%@dirrm share/examples/tinker
-%%PORTDOCS%%@dirrm share/tinker/bench
-@dirrm share/tinker/params
-%%WITH_VIEWER%%@dirrm share/tinker/rasmol
-%%PORTDOCS%%@dirrm share/tinker/test
-@dirrm share/tinker
+%%PORTDOCS%%@dirrm %%DATADIR%%/bench
+@dirrm %%DATADIR%%/params
+%%WITH_VIEWER%%@dirrm %%DATADIR%%/rasmol
+%%PORTDOCS%%@dirrm %%DATADIR%%/test
+@dirrm %%DATADIR%%