summaryrefslogtreecommitdiff
blob: af75b515c81e99d8c3ff5e00e0161fe31ac7dd95 (plain)
1
2
3
4
5
6
7
8
9
10
11
12
13
14
15
16
17
18
19
20
21
22
23
24
25
26
27
28
29
30
31
32
33
34
35
36
37
38
39
40
41
42
43
44
45
46
47
48
49
50
51
52
53
54
55
56
57
58
59
60
61
62
63
64
65
66
67
68
69
70
71
72
73
74
75
76
77
78
79
80
81
82
83
84
85
86
87
88
89
90
91
92
93
94
95
96
97
98
99
100
101
102
103
104
105
106
107
108
109
110
111
112
113
114
115
116
117
118
119
120
121
122
123
124
125
126
127
128
129
130
131
132
133
134
135
136
137
138
139
140
141
142
143
144
145
146
147
148
149
150
151
152
153
154
155
156
157
158
159
160
161
162
163
164
165
166
167
168
169
170
171
172
173
174
175
176
177
178
179
180
181
182
183
184
185
186
187
188
189
190
191
192
193
194
195
196
197
198
199
200
201
202
203
204
205
206
207
208
209
210
211
212
213
214
# Copyright 1999-2012 Gentoo Foundation
# Distributed under the terms of the GNU General Public License v2
# $Header: /var/cvsroot/gentoo-x86/sci-chemistry/ccpn/ccpn-2.1.5_p120109.ebuild,v 1.1 2012/01/09 12:42:11 jlec Exp $

EAPI="3"

PYTHON_DEPEND="2:2.5"
PYTHON_USE_WITH="ssl tk"

inherit eutils portability python toolchain-funcs versionator

PATCHSET="${PV##*_p}"
MY_PN="${PN}mr"
MY_PV="$(replace_version_separator 3 _ ${PV%%_p*})"
MY_MAJOR="$(get_version_component_range 1-3)"

DESCRIPTION="The Collaborative Computing Project for NMR"
HOMEPAGE="http://www.ccpn.ac.uk/ccpn"
SRC_URI="http://www.bio.cam.ac.uk/ccpn/download/${MY_PN}/analysis${MY_PV}.tar.gz"
	[[ -n ${PATCHSET} ]] && SRC_URI="${SRC_URI}	http://dev.gentoo.org/~jlec/distfiles/ccpn-update-${MY_MAJOR}-${PATCHSET}.patch.xz"

SLOT="0"
LICENSE="|| ( CCPN LGPL-2.1 )"
KEYWORDS="~amd64 ~x86 ~amd64-linux ~x86-linux"
IUSE="extendnmr +opengl"

RDEPEND="
	dev-lang/tk[threads]
	>=dev-python/numpy-1.4
	>=dev-tcltk/tix-8.4.3
	=sci-libs/ccpn-data-"${MY_MAJOR}"*
	>=sci-libs/ccpn-data-2.1.5_p111011
	sci-biology/psipred
	x11-libs/libXext
	x11-libs/libX11
	opengl? (
		media-libs/freeglut
		dev-python/pyglet )"
# We need to fix this
#		sci-chemistry/mdd
DEPEND="${RDEPEND}"
PDEPEND="
	extendnmr? (
		<=sci-chemistry/aria-2.3.2
		sci-chemistry/prodecomp )"

RESTRICT="mirror"

S="${WORKDIR}"/${MY_PN}/${MY_PN}$(get_version_component_range 1-2 ${PV})

pkg_setup() {
	python_set_active_version 2
}

src_prepare() {
	[[ -n ${PATCHSET} ]] && \
		epatch "${WORKDIR}"/ccpn-update-${MY_MAJOR}-${PATCHSET}.patch

	epatch "${FILESDIR}"/${MY_PV}-parallel.patch

	sed \
		-e "/PSIPRED_DIR/s:'data':'share/psipred/data':g" \
		-e "s:weights_s:weights:g" \
		-i python/ccpnmr/analysis/wrappers/Psipred.py || die

	local tk_ver
	local myconf

	tk_ver="$(best_version dev-lang/tk | cut -d- -f3 | cut -d. -f1,2)"

	if use opengl; then
		GLUT_NEED_INIT="-DNEED_GLUT_INIT"
		IGNORE_GL_FLAG=""
		GL_FLAG="-DUSE_GL_TRUE"
		GL_DIR="${EPREFIX}/usr"
		GL_LIB="-lglut -lGLU -lGL"
		GL_INCLUDE_FLAGS="-I\$(GL_DIR)/include"
		GL_LIB_FLAGS="-L\$(GL_DIR)/$(get_libdir)"

	else
		IGNORE_GL_FLAG="-DIGNORE_GL"
		GL_FLAG="-DUSE_GL_FALSE"
	fi

	GLUT_NOT_IN_GL=""
	GLUT_FLAG="\$(GLUT_NEED_INIT) \$(GLUT_NOT_IN_GL)"

	rm -rf data model doc license || die

	sed \
		-e "s|/usr|${EPREFIX}/usr|g" \
		-e "s|^\(CC =\).*|\1 $(tc-getCC)|g" \
		-e "s|^\(OPT_FLAG =\).*|\1 ${CFLAGS}|g" \
		-e "s|^\(LINK_FLAGS =.*\)|\1 ${LDFLAGS}|g" \
		-e "s|^\(IGNORE_GL_FLAG =\).*|\1 ${IGNORE_GL_FLAG}|g" \
		-e "s|^\(GL_FLAG =\).*|\1 ${GL_FLAG}|g" \
		-e "s|^\(GL_DIR =\).*|\1 ${GL_DIR}|g" \
		-e "s|^\(GL_LIB =\).*|\1 ${GL_LIB}|g" \
		-e "s|^\(GL_LIB_FLAGS =\).*|\1 ${GL_LIB_FLAGS}|g" \
		-e "s|^\(GL_INCLUDE_FLAGS =\).*|\1 ${GL_INCLUDE_FLAGS}|g" \
		-e "s|^\(GLUT_NEED_INIT =\).*|\1 ${GLUT_NEED_INIT}|g" \
		-e "s|^\(GLUT_NOT_IN_GL =\).*|\1|g" \
		-e "s|^\(X11_LIB_FLAGS =\).*|\1 -L${EPREFIX}/usr/$(get_libdir)|g" \
		-e "s|^\(TCL_LIB_FLAGS =\).*|\1 -L${EPREFIX}/usr/$(get_libdir)|g" \
		-e "s|^\(TK_LIB_FLAGS =\).*|\1 -L${EPREFIX}/usr/$(get_libdir)|g" \
		-e "s|^\(PYTHON_INCLUDE_FLAGS =\).*|\1 -I${EPREFIX}/$(python_get_includedir)|g" \
		-e "s|^\(PYTHON_LIB =\).*|\1 $(python_get_library -l)|g" \
		c/environment_default.txt > c/environment.txt
}

src_compile() {
	emake -C c all links || die
}

src_install() {
	local libdir
	local tkver
	local _wrapper

	find . -name "*.pyc" -type d -delete

	libdir=$(get_libdir)
	tkver=$(best_version dev-lang/tk | cut -d- -f3 | cut -d. -f1,2)

	_wrapper="analysis dangle dataShifter depositionFileImporter eci formatConverter pipe2azara"
	use extendnmr && _wrapper="${_wrapper} extendNmr"
	for wrapper in ${_wrapper}; do
		sed \
			-e "s|gentoo_sitedir|${EPREFIX}$(python_get_sitedir)|g" \
		   -e "s|gentoolibdir|${EPREFIX}/usr/${libdir}|g" \
			-e "s|gentootk|${EPREFIX}/usr/${libdir}/tk${tkver}|g" \
			-e "s|gentootcl|${EPREFIX}/usr/${libdir}/tclk${tkver}|g" \
			-e "s|gentoopython|${EPREFIX}/usr/bin/python|g" \
			-e "s|gentoousr|${EPREFIX}/usr|g" \
			-e "s|//|/|g" \
			"${FILESDIR}"/${wrapper} > "${T}"/${wrapper} || die "Fail fix ${wrapper}"
		dobin "${T}"/${wrapper} || die "Failed to install ${wrapper}"
	done

	local in_path
	local files
	local pydocs

	pydocs="$(find python -name doc -type d)"
	rm -rf ${pydocs} || die

	in_path=$(python_get_sitedir)/${PN}

	for i in python/memops/format/compatibility/{Converters,part2/Converters2}.py; do
	sed \
		-e 's|#from __future__|from __future__|g' \
		-i ${i} || die
	done

	insinto ${in_path}

	dodir ${in_path}/c

	ebegin "Installing main files"
		doins -r python || die "main files installation failed"
	eend

	einfo "Adjusting permissions"

	files="
		cambridge/c/BayesPeakSeparator.so
		ccp/c/StructUtil.so
		ccp/c/StructStructure.so
		ccp/c/StructBond.so
		ccp/c/StructAtom.so
		ccpnmr/c/DyAtomCoord.so
		ccpnmr/c/DyDistConstraint.so
		ccpnmr/c/DyDistForce.so
		ccpnmr/c/AtomCoordList.so
		ccpnmr/c/DyAtomCoordList.so
		ccpnmr/c/ContourStyle.so
		ccpnmr/c/ContourLevels.so
		ccpnmr/c/SliceFile.so
		ccpnmr/c/PeakCluster.so
		ccpnmr/c/Dynamics.so
		ccpnmr/c/Bacus.so
		ccpnmr/c/Midge.so
		ccpnmr/c/DyDistConstraintList.so
		ccpnmr/c/WinPeakList.so
		ccpnmr/c/PeakList.so
		ccpnmr/c/DistConstraint.so
		ccpnmr/c/CloudUtil.so
		ccpnmr/c/DistForce.so
		ccpnmr/c/DistConstraintList.so
		ccpnmr/c/AtomCoord.so
		ccpnmr/c/DyDynamics.so
		ccpnmr/c/ContourFile.so
		memops/c/ShapeFile.so
		memops/c/BlockFile.so
		memops/c/PdfHandler.so
		memops/c/MemCache.so
		memops/c/FitMethod.so
		memops/c/PsHandler.so
		memops/c/GlHandler.so
		memops/c/StoreFile.so
		memops/c/StoreHandler.so
		memops/c/TkHandler.so"
	for FILE in ${files}; do
		fperms 755 ${in_path}/python/${FILE}
	done
}

pkg_postinst() {
	python_mod_optimize ${PN}
}

pkg_postrm() {
	python_mod_cleanup ${PN}
}