From b82d3afe9719e4bbc79c23a34dd4eeab7fa818f4 Mon Sep 17 00:00:00 2001 From: Jeffrey Gardner Date: Sun, 24 May 2009 23:52:34 +0000 Subject: manifest svn path=/; revision=280 --- sci-chemistry/namd/Manifest | 2 +- sci-chemistry/namd/namd-2.6.ebuild | 96 -------------------------------------- 2 files changed, 1 insertion(+), 97 deletions(-) delete mode 100644 sci-chemistry/namd/namd-2.6.ebuild diff --git a/sci-chemistry/namd/Manifest b/sci-chemistry/namd/Manifest index 889edd9..440f6f0 100644 --- a/sci-chemistry/namd/Manifest +++ b/sci-chemistry/namd/Manifest @@ -1,3 +1,3 @@ AUX namd-2.6-gentoo-amd64.patch 3603 RMD160 c73b9a273716c430004d87d36551a5474e6d3288 SHA1 a815851f7ebc8bb2533f38bb24b529765f2e6c54 SHA256 17f60d6add2b777726507c5badaf4dc5e0eb947d2c49c2562eda242aa8384435 DIST NAMD_2.7b1_Source.tar.gz 26302404 RMD160 ccb73606d3f0724c55ce022aa130656444825f5e SHA1 955e096a6c70e1e7786d10334bec3cae1eb4fff6 SHA256 cf48b659667fe9e03af27c8d434567525e924ebd08c801321c71361a8f166b2e -EBUILD namd-2.7.ebuild 2265 RMD160 eb54d7f8c81886d59b1a7a66ad58639db2dff476 SHA1 a2ab70155b25297bbe55f45343865c3125869367 SHA256 b618fcc84492d2f6828309a2ae79ee6d6f8a5033a5f85d4ec5ea846e6a917be8 +EBUILD namd-2.7.ebuild 2244 RMD160 f02c25aae72ea2165d923f58d4e7c1da13e01a48 SHA1 782d153320df1a6634a3962a6868b5ea9c5305e8 SHA256 747a19d3373be9efcbdf47f8a287c1c629415eccf00ff923555e4d187adaefc0 diff --git a/sci-chemistry/namd/namd-2.6.ebuild b/sci-chemistry/namd/namd-2.6.ebuild deleted file mode 100644 index ece7471..0000000 --- a/sci-chemistry/namd/namd-2.6.ebuild +++ /dev/null @@ -1,96 +0,0 @@ -# Copyright 1999-2006 Gentoo Foundation -# Distributed under the terms of the GNU General Public License v2 -# $Header: $ - -inherit eutils toolchain-funcs flag-o-matic - -DESCRIPTION="A powerful and highly parallelized molecular dynamics code" -LICENSE="namd" -HOMEPAGE="http://www.ks.uiuc.edu/Research/namd/" - -MY_PN="NAMD" -MY_PV="2.6" - -SRC_URI="${MY_PN}_${MY_PV}_Source.tar.gz" - -SLOT="0" -KEYWORDS="~amd64" -IUSE="" - -RESTRICT="fetch" - -DEPEND="|| ( app-shells/csh - app-shells/tcsh ) - virtual/libc - sys-cluster/charm - =sci-libs/fftw-2* - =dev-lang/tcl-8.4*" - -CHARM="charm-9999" -NAMD_ARCH="Linux-amd64-g++" - -NAMD_DOWNLOAD="http://www.ks.uiuc.edu/Development/Download/download.cgi?PackageName=NAMD" - -S="${WORKDIR}/${MY_PN}_${MY_PV}_Source" - -pkg_nofetch() { - echo - einfo "Please download ${MY_PN}_${MY_PV}_Source.tar.gz from" - einfo "${NAMD_DOWNLOAD}" - einfo "after agreeing to the license and then move it to" - einfo "${DISTDIR}" - einfo "Be sure to select the ${MY_PV} version!" - echo -} - -src_unpack() { - unpack ${A} - - # apply a few small fixes to make NAMD compile and - # link to the proper libraries - epatch "${FILESDIR}"/namd-2.6-gentoo-amd64.patch - - cd "${S}" - - # proper compiler and cflags - sed -e "s/g++/$(tc-getCXX)/" \ - -e "s/CXXOPTS = -O3 -march=pentiumpro -ffast-math -static/CXXOPTS = ${CXXFLAGS}/" \ - -e "s/gcc/$(tc-getCC)/" \ - -e "s/COPTS = -O3 -march=pentiumpro -ffast-math -static/COPTS = ${CFLAGS}/" \ - -i arch/${NAMD_ARCH}.arch || \ - die "Failed to setup ${NAMD_ARCH}.arch" - - # configure - ./config tcl fftw ${NAMD_ARCH} -} - -src_compile() { - # build namd - cd "${S}/${NAMD_ARCH}" - emake || die "Failed to build namd" -} - -src_install() { - cd "${S}/${NAMD_ARCH}" - - # the binaries - dobin ${PN}2 psfgen flipbinpdb flipdcd || \ - die "Failed to install binaries" - - cd "${S}" - - # some docs - dodoc announce.txt license.txt notes.txt || \ - die "Failed to install docs" -} - -pkg_postinst() { - echo - einfo "For detailed instructions on how to run and configure" - einfo "NAMD please consults the extensive documentation at" - einfo "http://www.ks.uiuc.edu/Research/namd/" - einfo "and the NAMD tutorials available at" - einfo "http://www.ks.uiuc.edu/Training/Tutorials/" - einfo "Have fun :)" - echo -} -- cgit v1.2.3-65-gdbad