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# Created by: Glenn Johnson
# $FreeBSD$

PORTNAME=   tinker
PORTVERSION=    6.1.01
CATEGORIES= biology
MASTER_SITES=   http://dasher.wustl.edu/tinker/downloads/

MAINTAINER= ports@FreeBSD.org
COMMENT=    A general purpose molecular modelling package

RESTRICTED= author requests no distribution except from his FTP site

OPTIONS_DEFINE= OPTIMIZED_FFLAGS DATA DOCS EXAMPLES
OPTIONS_DEFAULT=DATA
OPTIMIZED_FFLAGS_DESC=  compilation optimizations

WRKSRC=     ${WRKDIR}/${PORTNAME}
BUILD_WRKSRC=   ${WRKSRC}/source
INSTALL_WRKSRC= ${WRKSRC}/source

USE_FORTRAN=    yes
MAKE_ENV=   HAVE_G2C=yes
MAKEFILE=   ${WRKSRC}/make/Makefile
ALL_TARGET= all listing
INSTALL_TARGET= rename
MAKE_JOBS_SAFE= yes

SUB_FILES=  pkg-message

DOCS=       0README *.pdf *.txt
SAMPLES=    0README *.make *.dyn *.int *.frac *.key *.seq *.pdb *.xyz
BENCHES=    0README *.dyn0 *.log *.key *.run *.xyz results*

.include <bsd.port.pre.mk>

.if ${PORT_OPTIONS:MOPTIMIZED_FFLAGS}
FFLAGS+=    -O3 -ffast-math -finline-functions -fomit-frame-pointer -funroll-loops -fexpensive-optimizations
.if (${ARCH} == "i386")
FFLAGS+=    -mfancy-math-387 -malign-double
.endif # i386
.endif

.if empty(PORT_OPTIONS:MDATA)
NOPORTDATA= yes
.endif

post-extract:
    @${CHMOD} -R u+w ${WRKSRC}

post-install:
    @${MKDIR} ${DATADIR}
    ${INSTALL_DATA} ${INSTALL_WRKSRC}/tinker.txt ${DATADIR}
    @${MKDIR} ${DATADIR}/params
    ${INSTALL_DATA} ${WRKSRC}/params/* ${DATADIR}/params
.if ${PORT_OPTIONS:MDATA}
    @${MKDIR} ${DATADIR}/bench
    ${INSTALL_DATA} ${BENCHES:S|^|${WRKSRC}/bench/|} ${DATADIR}/bench
    @${MKDIR} ${DATADIR}/test
    ${INSTALL_DATA} ${WRKSRC}/test/* ${DATADIR}/test
.endif
.if ${PORT_OPTIONS:MDOCS}
    @${MKDIR} ${DOCSDIR}
    ${INSTALL_DATA} ${DOCS:S|^|${WRKSRC}/doc/|} ${DOCSDIR}
.endif
.if ${PORT_OPTIONS:MEXAMPLES}
    @${MKDIR} ${EXAMPLESDIR}
    ${INSTALL_DATA} ${SAMPLES:S|^|${WRKSRC}/example/|} ${EXAMPLESDIR}
.endif
    @${ECHO_CMD}
    @${CAT} ${PKGMESSAGE}
    @${ECHO_CMD}

.include <bsd.port.post.mk>