mole-bin: Replacement for Caver, including Pymol plugin.

2 files changed, 50 insertions, 0 deletions

diff --git a/sci-chemistry/mole-bin/Manifest b/sci-chemistry/mole-bin/Manifest
new file mode 100644
index 0000000..a9af3c3
--- /dev/null
+++ b/sci-chemistry/mole-bin/Manifest
@@ -0,0 +1,2 @@
+DIST mole-install.tar.gz 1610527 RMD160 fa6adb8cd23635f651b05046dc8ee1e9eefaa87c SHA1 003564745f895a28a32a9b40f990fb214eb7429f SHA256 22820c1c1fe9000fc9d756068b037d93928d30d67900291cd8346ab3fda3aa27
+EBUILD mole-bin-1.2.ebuild 1112 RMD160 aed95b2f453040d510778a35ab3243cd4aae5956 SHA1 f5b85fd3d09d751bf68ed38c089e9fa0597c613f SHA256 428b91b21cfeb07c3db23434da189dade0a1796bf8985e717f38289f12dfe263
diff --git a/sci-chemistry/mole-bin/mole-bin-1.2.ebuild b/sci-chemistry/mole-bin/mole-bin-1.2.ebuild
new file mode 100644
index 0000000..5ea70dd
--- /dev/null
+++ b/sci-chemistry/mole-bin/mole-bin-1.2.ebuild
@@ -0,0 +1,48 @@
+# Copyright 1999-2008 Gentoo Foundation
+# Distributed under the terms of the GNU General Public License v2
+# $Header: $
+
+inherit eutils multilib python distutils
+
+MY_P="mole-install"
+PYTHON_MODNAME="pmg_tk/startup"
+
+DESCRIPTION="A toolkit for automated location channels, tunnels and pores in molecular structures"
+HOMEPAGE="http://mole.chemi.muni.cz/"
+SRC_URI="http://mole.chemi.muni.cz/binary/linux/mole_v${PV}/${MY_P}.tar.gz"
+LICENSE=""
+SLOT="0"
+KEYWORDS="~amd64 ~x86"
+IUSE="pymol"
+RDEPEND="pymol? ( sci-chemistry/pymol )
+	media-libs/qhull"
+DEPEND="${RDEPEND}"
+S="${WORKDIR}/${MY_P}"
+
+src_compile() {
+	:
+}
+
+src_install() {
+	if use pymol; then
+		python_version
+		insinto /usr/$(get_libdir)/python${PYVER}/site-packages/pmg_tk/startup
+		doins mole.py || die
+	fi
+
+	exeinto /opt/mole/bin
+	doexe bin/Mole.exe || die
+	dosym ../mole/bin/Mole.exe /opt/bin/mole || die
+
+	edos2unix dat/* || die
+	insinto /opt/mole/share
+	doins -r dat examples || die
+	dohtml README.html || die
+	dodoc README.txt || die
+
+	cat >> "${T}"/${PN} <<- EOF
+	TEMP="\${TMP}"
+	MOLEDIR="/opt/mole/share"
+	EOF
+	newenvd "${T}"/${PN} 20${PN} || die
+}