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author | Repository QA checks <repo-qa-checks@gentoo.org> | 2017-12-01 23:15:47 +0000 |
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committer | Repository QA checks <repo-qa-checks@gentoo.org> | 2017-12-01 23:15:47 +0000 |
commit | 45794700f4c0e93a39258e04f89d7bf7650b5ba2 (patch) | |
tree | f4c60b17ee5971174b07552228f3b6244ed8b2e9 /metadata/md5-cache/sci-chemistry | |
parent | Merge updates from master (diff) | |
download | gentoo-45794700f4c0e93a39258e04f89d7bf7650b5ba2.tar.gz gentoo-45794700f4c0e93a39258e04f89d7bf7650b5ba2.tar.bz2 gentoo-45794700f4c0e93a39258e04f89d7bf7650b5ba2.zip |
2017-12-01 23:15:45 UTC
Diffstat (limited to 'metadata/md5-cache/sci-chemistry')
11 files changed, 22 insertions, 22 deletions
diff --git a/metadata/md5-cache/sci-chemistry/gsim-21.3 b/metadata/md5-cache/sci-chemistry/gsim-21.3 index 759dcff29207..19d93d69e844 100644 --- a/metadata/md5-cache/sci-chemistry/gsim-21.3 +++ b/metadata/md5-cache/sci-chemistry/gsim-21.3 @@ -1,6 +1,6 @@ DEFINED_PHASES=compile configure install prepare unpack DEPEND=dev-cpp/muParser media-libs/freetype sci-libs/libcmatrix sci-libs/minuit virtual/blas dev-qt/qtsvg:4 emf? ( media-libs/libemf ) opengl? ( dev-qt/qtopengl:4 ) virtual/pkgconfig -DESCRIPTION=Programm for visualisation and processing of experimental and simulated NMR spectra +DESCRIPTION=Visualisation and processing of experimental and simulated NMR spectra EAPI=5 HOMEPAGE=https://sourceforge.net/projects/gsim/ IUSE=emf opengl @@ -10,4 +10,4 @@ RDEPEND=dev-cpp/muParser media-libs/freetype sci-libs/libcmatrix sci-libs/minuit SLOT=0 SRC_URI=mirror://sourceforge/gsim/gsim-21.3.tar.gz _eclasses_=base 983774947da124fb7d542ce25a218bb1 desktop 2ccd1dd1dd7bfb8795eea024a4f91bb6 epatch 8233751dc5105a6ae8fcd86ce2bb0247 estack 43ddf5aaffa7a8d0482df54d25a66a1f eutils 97ce9decef1ff4b6c5be700283f67343 ltprune 2770eed66a9b8ef944714cd0e968182e multilib 97f470f374f2e94ccab04a2fb21d811e qmake-utils 990448b067cb3cfe1443bc25fb57239c qt4-r2 b7985a3197fbc3a22d059f19904e735b toolchain-funcs 185a06792159ca143528e7010368e8af -_md5_=952b237476b1e3b1d25e73077cf5ea4f +_md5_=8b4d9903ad01081c70ba10643f5542c2 diff --git a/metadata/md5-cache/sci-chemistry/molscript-2.1.2-r2 b/metadata/md5-cache/sci-chemistry/molscript-2.1.2-r2 index eeac494f978b..6daa313972ed 100644 --- a/metadata/md5-cache/sci-chemistry/molscript-2.1.2-r2 +++ b/metadata/md5-cache/sci-chemistry/molscript-2.1.2-r2 @@ -1,6 +1,6 @@ DEFINED_PHASES=compile install prepare DEPEND=media-libs/freeglut media-libs/gd:2= media-libs/libpng:0= virtual/jpeg:0= || ( x11-libs/libXmu x11-libs/libXext x11-libs/libX11 ) -DESCRIPTION=Display molecular 3D structures, such as proteins, in both schematic and detailed representations +DESCRIPTION=Display 3D molecules (e.g., proteins) in schematic and detailed representations EAPI=5 HOMEPAGE=http://www.avatar.se/molscript/ KEYWORDS=amd64 ppc x86 ~amd64-linux ~x86-linux @@ -10,4 +10,4 @@ RESTRICT=fetch SLOT=0 SRC_URI=molscript-2.1.2.tar.gz _eclasses_=desktop 2ccd1dd1dd7bfb8795eea024a4f91bb6 epatch 8233751dc5105a6ae8fcd86ce2bb0247 estack 43ddf5aaffa7a8d0482df54d25a66a1f eutils 97ce9decef1ff4b6c5be700283f67343 ltprune 2770eed66a9b8ef944714cd0e968182e multilib 97f470f374f2e94ccab04a2fb21d811e toolchain-funcs 185a06792159ca143528e7010368e8af -_md5_=eb0013ea21e1b6460673297657b6c433 +_md5_=c1991e872be752de44194c5a181e2c17 diff --git a/metadata/md5-cache/sci-chemistry/msms-bin-2.6.1-r1 b/metadata/md5-cache/sci-chemistry/msms-bin-2.6.1-r1 index dbd94df04315..f5b34693949b 100644 --- a/metadata/md5-cache/sci-chemistry/msms-bin-2.6.1-r1 +++ b/metadata/md5-cache/sci-chemistry/msms-bin-2.6.1-r1 @@ -1,5 +1,5 @@ DEFINED_PHASES=install -DESCRIPTION=MSMS allows to compute very efficiently triangulations of Solvent Excluded Surfaces +DESCRIPTION=MSMS very efficiently computes triangulations of Solvent Excluded Surfaces EAPI=4 HOMEPAGE=http://mgl.scripps.edu/people/sanner/html/msms_home.html KEYWORDS=~amd64 ~x86 ~amd64-linux ~x86-linux @@ -7,4 +7,4 @@ LICENSE=MSMS RESTRICT=fetch SLOT=0 SRC_URI=amd64? ( msms_i86_64Linux2_2.6.1.tar.gz ) x86? ( msms_i86Linux2_2.6.1.tar.gz ) -_md5_=3bed25085e21d3be0ead51b25101c70b +_md5_=c43ab98fd504ae15a5c6f4c778ac6daf diff --git a/metadata/md5-cache/sci-chemistry/pdb-tools-0.2.1-r1 b/metadata/md5-cache/sci-chemistry/pdb-tools-0.2.1-r1 index bac05d02bb1e..a95afee35b8a 100644 --- a/metadata/md5-cache/sci-chemistry/pdb-tools-0.2.1-r1 +++ b/metadata/md5-cache/sci-chemistry/pdb-tools-0.2.1-r1 @@ -1,6 +1,6 @@ DEFINED_PHASES=compile install prepare setup DEPEND=python_single_target_pypy? ( >=virtual/pypy-5:0= ) python_single_target_python2_7? ( >=dev-lang/python-2.7.5-r2:2.7 ) >=dev-lang/python-exec-2:=[python_targets_pypy(-)?,python_targets_python2_7(-)?,-python_single_target_jython2_7(-),-python_single_target_pypy3(-),-python_single_target_python3_4(-),-python_single_target_python3_5(-),-python_single_target_python3_6(-),python_single_target_pypy(+)?,python_single_target_python2_7(+)?] virtual/fortran -DESCRIPTION=Tools for manipulating and doing calculations on wwPDB macromolecule structure files +DESCRIPTION=Tools for manipulating and calculations on wwPDB macromolecule structure files EAPI=5 HOMEPAGE=https://github.com/harmslab/pdbtools IUSE=python_targets_pypy python_targets_python2_7 python_single_target_pypy python_single_target_python2_7 @@ -11,4 +11,4 @@ REQUIRED_USE=^^ ( python_single_target_pypy python_single_target_python2_7 ) pyt SLOT=0 SRC_URI=https://pdb-tools.googlecode.com/files/pdbTools_0.2.1.tar.gz _eclasses_=desktop 2ccd1dd1dd7bfb8795eea024a4f91bb6 epatch 8233751dc5105a6ae8fcd86ce2bb0247 estack 43ddf5aaffa7a8d0482df54d25a66a1f eutils 97ce9decef1ff4b6c5be700283f67343 fortran-2 9e7f20c99213f0627ff7f873d4aaa25d ltprune 2770eed66a9b8ef944714cd0e968182e multilib 97f470f374f2e94ccab04a2fb21d811e python-single-r1 317a2557b4d7319a7418225f65accf77 python-utils-r1 c9de01becf9df3f8c10aeec3dc693f5d toolchain-funcs 185a06792159ca143528e7010368e8af -_md5_=1351edf19d2820e89574c5ff43489439 +_md5_=65e79ac4a3cfe79480b4076c8296ae6d diff --git a/metadata/md5-cache/sci-chemistry/pdb-tools-0.2.1-r2 b/metadata/md5-cache/sci-chemistry/pdb-tools-0.2.1-r2 index 1c0ee81b63b4..8fcc574fa7e1 100644 --- a/metadata/md5-cache/sci-chemistry/pdb-tools-0.2.1-r2 +++ b/metadata/md5-cache/sci-chemistry/pdb-tools-0.2.1-r2 @@ -1,6 +1,6 @@ DEFINED_PHASES=compile install prepare setup DEPEND=python_targets_python2_7? ( >=dev-lang/python-2.7.5-r2:2.7 ) >=dev-lang/python-exec-2:=[python_targets_python2_7(-)?,-python_single_target_jython2_7(-),-python_single_target_pypy(-),-python_single_target_pypy3(-),-python_single_target_python3_4(-),-python_single_target_python3_5(-),-python_single_target_python3_6(-),python_single_target_python2_7(+)] virtual/fortran -DESCRIPTION=Tools for manipulating and doing calculations on wwPDB macromolecule structure files +DESCRIPTION=Tools for manipulating and calculations on wwPDB macromolecule structure files EAPI=5 HOMEPAGE=https://github.com/harmslab/pdbtools IUSE=python_targets_python2_7 @@ -11,4 +11,4 @@ REQUIRED_USE=python_targets_python2_7 SLOT=0 SRC_URI=https://pdb-tools.googlecode.com/files/pdbTools_0.2.1.tar.gz _eclasses_=desktop 2ccd1dd1dd7bfb8795eea024a4f91bb6 epatch 8233751dc5105a6ae8fcd86ce2bb0247 estack 43ddf5aaffa7a8d0482df54d25a66a1f eutils 97ce9decef1ff4b6c5be700283f67343 fortran-2 9e7f20c99213f0627ff7f873d4aaa25d ltprune 2770eed66a9b8ef944714cd0e968182e multilib 97f470f374f2e94ccab04a2fb21d811e python-single-r1 317a2557b4d7319a7418225f65accf77 python-utils-r1 c9de01becf9df3f8c10aeec3dc693f5d toolchain-funcs 185a06792159ca143528e7010368e8af -_md5_=f9f71182abfaac381b3fc033e7a068f5 +_md5_=6829f5fae8d0bf0ffdef84abe46217bb diff --git a/metadata/md5-cache/sci-chemistry/pdb2pqr-1.9.0-r1 b/metadata/md5-cache/sci-chemistry/pdb2pqr-1.9.0-r1 index 9322149a9eeb..2559d31ca2e3 100644 --- a/metadata/md5-cache/sci-chemistry/pdb2pqr-1.9.0-r1 +++ b/metadata/md5-cache/sci-chemistry/pdb2pqr-1.9.0-r1 @@ -1,6 +1,6 @@ DEFINED_PHASES=compile configure install prepare setup test DEPEND=python_targets_python2_7? ( >=dev-lang/python-2.7.5-r2:2.7 ) >=dev-lang/python-exec-2:=[python_targets_python2_7(-)?,-python_single_target_python2_7(-)] dev-python/numpy[python_targets_python2_7(-)?,-python_single_target_python2_7(-)] sci-chemistry/openbabel-python[python_targets_python2_7(-)?,-python_single_target_python2_7(-)] opal? ( dev-python/zsi[python_targets_python2_7(-)?,-python_single_target_python2_7(-)] ) pdb2pka? ( sci-chemistry/apbs[python_targets_python2_7(-)?,-python_single_target_python2_7(-),-mpi] ) dev-lang/swig:0 dev-util/scons virtual/fortran -DESCRIPTION=An automated pipeline for performing Poisson-Boltzmann electrostatics calculations +DESCRIPTION=Automated pipeline for performing Poisson-Boltzmann electrostatics calculations EAPI=5 HOMEPAGE=http://www.poissonboltzmann.org/ IUSE=doc examples opal +pdb2pka python_targets_python2_7 @@ -11,4 +11,4 @@ REQUIRED_USE=|| ( python_targets_python2_7 ) SLOT=0 SRC_URI=https://github.com/Electrostatics/apbs-pdb2pqr/releases/download/pdb2pqr-1.9.0/pdb2pqr-src-1.9.0.tar.gz _eclasses_=desktop 2ccd1dd1dd7bfb8795eea024a4f91bb6 epatch 8233751dc5105a6ae8fcd86ce2bb0247 estack 43ddf5aaffa7a8d0482df54d25a66a1f eutils 97ce9decef1ff4b6c5be700283f67343 flag-o-matic a6089a2a4027ae3da4a460dc87b21050 fortran-2 9e7f20c99213f0627ff7f873d4aaa25d ltprune 2770eed66a9b8ef944714cd0e968182e multibuild 72647e255187a1fadc81097b3657e5c3 multilib 97f470f374f2e94ccab04a2fb21d811e multiprocessing 6f5991c7101863d0b29df63990ad852e python-r1 e9350ec46bb5c9f3504b4fbe8b8d8987 python-utils-r1 c9de01becf9df3f8c10aeec3dc693f5d scons-utils fcace052aef60e6b0eb3023c26aa585a toolchain-funcs 185a06792159ca143528e7010368e8af -_md5_=277a039f856ae0c68d6abceb12d4badc +_md5_=787e26e15fbbe6ccc3debd3915e303dc diff --git a/metadata/md5-cache/sci-chemistry/pdbcns-2.0.010504 b/metadata/md5-cache/sci-chemistry/pdbcns-2.0.010504 index 9c683bfa0359..c86bbcb16707 100644 --- a/metadata/md5-cache/sci-chemistry/pdbcns-2.0.010504 +++ b/metadata/md5-cache/sci-chemistry/pdbcns-2.0.010504 @@ -1,5 +1,5 @@ DEFINED_PHASES=install -DESCRIPTION=Convert atom names for common amino acids and nucleic acid bases from PDB format to CNS or back +DESCRIPTION=Convert atom names for amino acids/nucleic acid bases between PDB and CNS format EAPI=4 HOMEPAGE=http://www.mybiosoftware.com/3d-molecular-model/314/ KEYWORDS=~amd64 ~x86 ~amd64-linux ~x86-linux @@ -7,4 +7,4 @@ LICENSE=BSD RDEPEND=dev-lang/perl SLOT=0 SRC_URI=https://dev.gentoo.org/~jlec/distfiles/pdbcns.2.0.010504.perl.tgz -_md5_=f167b7636f3008d03c5b5a4fa27d414e +_md5_=89c30d46542bd1560e7c844043f6096c diff --git a/metadata/md5-cache/sci-chemistry/prekin-6.51.081122-r1 b/metadata/md5-cache/sci-chemistry/prekin-6.51.081122-r1 index 4effb4f82fc0..49816abdda1b 100644 --- a/metadata/md5-cache/sci-chemistry/prekin-6.51.081122-r1 +++ b/metadata/md5-cache/sci-chemistry/prekin-6.51.081122-r1 @@ -1,6 +1,6 @@ DEFINED_PHASES=compile install prepare DEPEND=x11-libs/libXext x11-libs/libXmu x11-libs/libX11 x11-libs/libXt X? ( >=x11-libs/motif-2.3:0 ) -DESCRIPTION=Prepares molecular kinemages (input files for Mage & KiNG) from PDB-format coordinate files +DESCRIPTION=Prepares molecular kinemages from PDB-format coordinate files EAPI=2 HOMEPAGE=http://kinemage.biochem.duke.edu/software/prekin.php IUSE=X @@ -10,4 +10,4 @@ RDEPEND=x11-libs/libXext x11-libs/libXmu x11-libs/libX11 x11-libs/libXt X? ( >=x SLOT=0 SRC_URI=http://kinemage.biochem.duke.edu/downloads/software/prekin/prekin.6.51.081122.src.tgz _eclasses_=desktop 2ccd1dd1dd7bfb8795eea024a4f91bb6 epatch 8233751dc5105a6ae8fcd86ce2bb0247 estack 43ddf5aaffa7a8d0482df54d25a66a1f eutils 97ce9decef1ff4b6c5be700283f67343 ltprune 2770eed66a9b8ef944714cd0e968182e multilib 97f470f374f2e94ccab04a2fb21d811e toolchain-funcs 185a06792159ca143528e7010368e8af -_md5_=74da56bfd665dc0e2e02f09683a31550 +_md5_=b00f4c87d6c7171e4ba9e2ca6780b506 diff --git a/metadata/md5-cache/sci-chemistry/propka-3.1_p140511 b/metadata/md5-cache/sci-chemistry/propka-3.1_p140511 index 702a6576a73b..0ce95470c991 100644 --- a/metadata/md5-cache/sci-chemistry/propka-3.1_p140511 +++ b/metadata/md5-cache/sci-chemistry/propka-3.1_p140511 @@ -1,6 +1,6 @@ DEFINED_PHASES=compile configure install prepare test DEPEND=dev-python/setuptools[python_targets_python2_7(-)?,-python_single_target_python2_7(-)] python_targets_python2_7? ( >=dev-lang/python-2.7.5-r2:2.7 ) >=dev-lang/python-exec-2:=[python_targets_python2_7(-)?,-python_single_target_python2_7(-)] -DESCRIPTION=Prediction of the pKa values of ionizable groups in proteins and protein-ligand complexes +DESCRIPTION=pKa-value prediction of ionizable groups in protein and protein-ligand complexes EAPI=5 HOMEPAGE=http://propka.ki.ku.dk/ IUSE=python_targets_python2_7 @@ -12,4 +12,4 @@ RESTRICT=mirror bindist SLOT=0 SRC_URI=https://dev.gentoo.org/~jlec/distfiles/propka-3.1_p140511.tar.xz _eclasses_=desktop 2ccd1dd1dd7bfb8795eea024a4f91bb6 distutils-r1 372bbe39047c0a2550319a3a82f3e063 epatch 8233751dc5105a6ae8fcd86ce2bb0247 estack 43ddf5aaffa7a8d0482df54d25a66a1f eutils 97ce9decef1ff4b6c5be700283f67343 ltprune 2770eed66a9b8ef944714cd0e968182e multibuild 72647e255187a1fadc81097b3657e5c3 multilib 97f470f374f2e94ccab04a2fb21d811e multiprocessing 6f5991c7101863d0b29df63990ad852e python-r1 e9350ec46bb5c9f3504b4fbe8b8d8987 python-utils-r1 c9de01becf9df3f8c10aeec3dc693f5d toolchain-funcs 185a06792159ca143528e7010368e8af xdg-utils f2c8335407f0b935b0a96d4adf23ef25 -_md5_=ebb8e38b8268a314f0aedc878dc74b59 +_md5_=77a50416f48bdac3be53689262fbd770 diff --git a/metadata/md5-cache/sci-chemistry/shelx-20141228 b/metadata/md5-cache/sci-chemistry/shelx-20141228 index 7e92ab435a21..3f0caa8c1a9b 100644 --- a/metadata/md5-cache/sci-chemistry/shelx-20141228 +++ b/metadata/md5-cache/sci-chemistry/shelx-20141228 @@ -1,5 +1,5 @@ DEFINED_PHASES=install -DESCRIPTION=Programs for crystal structure determination from single-crystal diffraction data +DESCRIPTION=Crystal structure determination from single-crystal diffraction data EAPI=5 HOMEPAGE=http://shelx.uni-ac.gwdg.de/SHELX/ KEYWORDS=amd64 ppc x86 ~amd64-linux ~x86-linux @@ -7,4 +7,4 @@ LICENSE=free-noncomm RESTRICT=fetch SLOT=0 SRC_URI=amd64? ( anode_amd64.bz2 ciftab_amd64.bz2 shelxc_amd64.bz2 shelxd_amd64.bz2 shelxe_amd64.bz2 shelxl_amd64.bz2 shelxs_amd64.bz2 shelxt_amd64.bz2 shredcif_amd64.bz2 ) x86? ( anode_x86.bz2 ciftab_x86.bz2 shelxc_x86.bz2 shelxd_x86.bz2 shelxe_x86.bz2 shelxl_x86.bz2 shelxs_x86.bz2 shelxt_x86.bz2 shredcif_x86.bz2 ) -_md5_=b66443b048e30f88389ac6ad4c1ca172 +_md5_=b169253fd8af7308865dff74b5225d8f diff --git a/metadata/md5-cache/sci-chemistry/suitename-0.3.070628 b/metadata/md5-cache/sci-chemistry/suitename-0.3.070628 index b62102b3dcad..455fc88379d5 100644 --- a/metadata/md5-cache/sci-chemistry/suitename-0.3.070628 +++ b/metadata/md5-cache/sci-chemistry/suitename-0.3.070628 @@ -1,5 +1,5 @@ DEFINED_PHASES=compile install prepare -DESCRIPTION=The ROC RNA Ontology Consortium consensus RNA backbone nomenclature and conformer-list development +DESCRIPTION=The ROC RNA Ontology nomenclature and conformer-list development EAPI=4 HOMEPAGE=http://kinemage.biochem.duke.edu/software/suitename.php KEYWORDS=~amd64 ~x86 ~amd64-linux ~x86-linux @@ -7,4 +7,4 @@ LICENSE=richardson SLOT=0 SRC_URI=http://kinemage.biochem.duke.edu/downloads/software/suitename/suitename.0.3.070628.src.tgz _eclasses_=multilib 97f470f374f2e94ccab04a2fb21d811e toolchain-funcs 185a06792159ca143528e7010368e8af -_md5_=f3751bdbdbce7b48ea8c66ac68009342 +_md5_=23e3046482e340a86f5452a8901c8c44 |