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* - Update to 0.9.4wen2019-03-252-4/+4
* science/erkale: Update g20190118 -> g20190318yuri2019-03-212-6/+5
* science/libcint: Update 3.0.14 -> 3.0.15yuri2019-03-212-5/+5
* Switch to devel/llvm80 for DEFAULT_VERSIONSjbeich2019-03-203-1/+3
* science/nwchem: Update 6.8.1.20190314 -> 6.8.1.20190319yuri2019-03-202-5/+8
* science/molsketch: Update 0.5.2 -> 0.6.0yuri2019-03-195-34/+8
* Re-add science/py-veusz: the latest version builds with Qt5yuri2019-03-185-0/+52
* Add py-geometer 0.1.2sunpoet2019-03-184-0/+46
* science/lammps: Update 12Dec2018 -> 28Feb2019yuri2019-03-183-4/+5
* science/nwchem: 6.8.1.20190222 (d8ac0a182) -> 6.8.1.20190314 (b959e5ee0)yuri2019-03-172-5/+5
* Qt4 deprecation: Remove Qt4 and its consumes.tcberner2019-03-1739-2940/+0
* science/libgeodecomp: remove QT4 option (Qt4 drpecation)tcberner2019-03-171-13/+2
* science/kst2: remove QT4/QT5 options (Qt4 deprecation)tcberner2019-03-171-24/+6
* science/py-gsd: Update 1.6.0 -> 1.6.1yuri2019-03-172-4/+4
* science/sparta: Update 29Oct2018 -> 15Feb2019yuri2019-03-172-5/+6
* science/tinker: Update 8.5.3 -> 8.6.1yuri2019-03-163-17/+18
* science/silo: remove QT4 option (Qt4 deprecation)tcberner2019-03-162-18/+1
* science/coordgenlibs: Update 1.2.1 -> 1.2.2yuri2019-03-163-5/+5
* Remove unused USE_PYTHON values.mat2019-03-131-1/+1
* Fix build on gcc-based architectures:linimon2019-03-131-2/+3
* Fix build on gcc-based architectures:linimon2019-03-131-1/+1
* Fix build on gcc-based architectures:linimon2019-03-131-3/+2
* - Update devel/gdcm to 2.8.9.stephen2019-03-101-1/+1
* science/massxpert: Update 3.4.0 -> 3.6.1yuri2019-03-108-93/+52
* Update to 2.0.1sunpoet2019-03-092-4/+4
* Update KDE Applications to 18.12.3tcberner2019-03-082-6/+6
* Remove expired ports:rene2019-03-0713-536/+0
* - Upgrade science/cgnslib to 3.4.0thierry2019-03-077-57/+17
* science/dvc: Update 0.30.0 -> 0.30.1yuri2019-03-062-4/+4
* science/quantum-espresso: Update 6.3 -> 6.4yuri2019-03-064-27/+19
* Update devel/doxygen to 1.8.15antoine2019-03-062-3/+1
* science/hypre: unbreak with libc++ 8jbeich2019-03-051-0/+5
* science/wxmacmolplt: Unbreak, it was crashing with WX-3.1yuri2019-03-031-1/+2
* science/dvc: Update 0.29.0 -> 0.30.0yuri2019-03-032-4/+4
* science/abinit: Broken on i386yuri2019-03-031-0/+1
* Update science/netcdf to 4.6.3sunpoet2019-03-0317-16/+22
* Upgrade to 5.3.2.thierry2019-03-033-38/+42
* science/coordgenlibs: Update 1.2 -> 1.2.1yuri2019-03-023-6/+5
* science/maeparser: Update 1.0.1 -> 1.1yuri2019-03-023-6/+8
* - Update to 1.1.1wen2019-02-282-5/+4
* science/qbox: fix build on powerpc*yuri2019-02-282-1/+26
* science/py-lifelines: update to 0.19.5rm2019-02-282-5/+7
* - Add USES=compiler:c11 to fix build on GCC architectures;thierry2019-02-281-4/+4
* science/p5-Mcstas-Tools: Merge {do,post}-installtobik2019-02-271-2/+0
* science/p5-Mcstas-Tools: Update to 2.5tobik2019-02-273-41/+56
* science/abinit: Add the 'test' targetyuri2019-02-271-0/+3
* science/abinit: Add OPENMP and MPI optionsyuri2019-02-271-1/+15
* science/nwchem: Update 6.8.1.20190125 -> 6.8.1.20190222yuri2019-02-262-7/+6
* Unmark as broken now that wxgtk31 is hooked into the frameworkbapt2019-02-251-2/+0
* wxGTK3.0: switch to gtk3 and webkit2bapt2019-02-252-1/+3
* science/vipster: Update 1.14.1a -> 1.15byuri2019-02-253-41/+51
* Update to 2.0.0sunpoet2019-02-252-4/+4
* Update to 2.1.1sunpoet2019-02-252-7/+7
* science/dlib-cpp and science/py-dlib: Update to 19.16.arrowd2019-02-245-15/+30
* science/py-quantities: Update 0.12.2 -> 0.12.3yuri2019-02-242-5/+4
* science/rdkit: Update 2018_09_1 -> 2018_09_2yuri2019-02-232-5/+4
* Update to 1.2.0sunpoet2019-02-233-7/+6
* Backout r493559bapt2019-02-221-1/+1
* Remove USE_GNOME=gnomemimedata which wasn't doing anything anymorebapt2019-02-221-1/+1
* science/abinit: Update 8.10.2 -> 8.10.3yuri2019-02-222-4/+4
* science/dvc: Update 0.28.2 -> 0.29.0yuri2019-02-222-4/+4
* science/mcstas-comps: Update to 2.5 and unbreakkai2019-02-213-37/+275
* Update to 2.3.2sunpoet2019-02-212-4/+4
* Update to 2.12.0sunpoet2019-02-203-6/+29
* New port: science/dvc: Git for data scientists: manage code and data togetheryuri2019-02-194-0/+55
* Update to 1.37sunpoet2019-02-182-4/+4
* Update WWWsunpoet2019-02-181-1/+1
* science/pcmsolver: Update 1.2.2 -> 1.2.3yuri2019-02-172-4/+4
* science/gromacs: Update 2019 -> 2019.1yuri2019-02-172-4/+4
* science/libgridxc: Update 0.8.4 -> 0.8.5yuri2019-02-172-5/+4
* Update to 1.5.0sunpoet2019-02-172-4/+4
* science/openstructure: python:2.7 for nowyuri2019-02-171-2/+2
* Remove bogus dependency, erkale links against libomp from llvmantoine2019-02-161-1/+0
* Remove bogus dependency, agrum links against libomp from llvm portantoine2019-02-161-1/+0
* Unbreak INDEXantoine2019-02-161-1/+1
* Move: science/mmtf -> science/mmtf-cppyuri2019-02-166-5/+5
* science/agrum: Fix warning messages of 'make describe'yuri2019-02-142-3/+5
* New port: science/opsin: Open Parser for Systematic IUPAC Nomenclature of che...yuri2019-02-145-0/+79
* - Update to 1.2.2wen2019-02-142-4/+4
* science/jmol: Add the executable jmoldata for headless operationyuri2019-02-132-5/+12
* Re-add: science/jmol: Java 3D viewer for chemical structuresyuri2019-02-135-0/+84
* New port: science/molscript: Display 3D molecules in schematic and detailed r...yuri2019-02-138-0/+190
* Update to 1.0.4sunpoet2019-02-133-8/+8
* science/py-pymol: Update 2.2.0 -> 2.3.0yuri2019-02-125-28/+24
* science/mmtf: Update g20180730 -> 1.0.0yuri2019-02-123-7/+6
* science/gabedit: Update 2.5.0 -> 2.5.1yuri2019-02-112-9/+10
* science/healpix: fix build with GCC-based architecturesyuri2019-02-111-1/+1
* science/spglib: 1.11.2.1 -> 1.12.2yuri2019-02-102-4/+4
* science/agrum: Update 0.13.6 -> 0.14.1yuri2019-02-103-15/+26
* science/abinit: Update 8.8.4 -> 8.10.2yuri2019-02-102-5/+4
* Update to 1.9.6sunpoet2019-02-102-10/+12
* New port: science/py-oddt: Open Drug Discovery Toolkityuri2019-02-104-0/+37
* Update KDE Applications to 18.12.2tcberner2019-02-084-8/+6
* science/paraview: update to 5.6.0fernape2019-02-085-357/+558
* Update WWWsunpoet2019-02-051-1/+1
* Update PORTSCOUTsunpoet2019-02-051-1/+1
* Update to 1.9.0sunpoet2019-02-053-7/+8
* Update PORTSCOUTsunpoet2019-02-051-2/+3
* py-abipy is not compatible with python2antoine2019-02-051-1/+1
* science/py-pymatgen: python-3 onlyyuri2019-02-051-1/+1
* science/py-pymatgen: Update 2018.10.18 -> 2019.1.24yuri2019-02-052-4/+5
* science/gramps: Update to 5.0.1woodsb022019-02-043-32/+7
* Deprecate ports broken for more than 6 monthsantoine2019-02-042-0/+4
* Move Objective-C ports to the v2 GNUstep ABI.theraven2019-02-033-3/+3
* science/ALPSCore: Mark broken on i386tobik2019-02-031-1/+3
* science/pcmsolver: Update 1.2.1 -> 1.2.2yuri2019-01-312-5/+4
* science/py-spglib: Update 1.11.1 -> 1.12.0yuri2019-01-312-5/+4
* New port: science/healpix: Software for pixelization, visualization, etc of d...yuri2019-01-286-0/+105
* New port: science/nwchem-data: Data for NWChem, the computational chemistry s...yuri2019-01-276-8/+49
* science/nwchem: Update 6.8.1.20181107 -> 6.8.1.20190125yuri2019-01-273-11/+6
* science/datawarrior: Update 4.7.2 -> 5.0.0yuri2019-01-262-4/+4
* science/py-pymatgen: Update 2018.9.30 -> 2018.10.18yuri2019-01-262-5/+4
* science/py-gpaw: Update 1.5.0 -> 1.5.1yuri2019-01-262-4/+4
* science/cp2k: Remove contiguous blank linesyuri2019-01-261-1/+0
* science/cp2k: Add missing executables that should be installedyuri2019-01-261-3/+8
* Conditionalize the dependence of libunwind to x86-only to allow buildinglinimon2019-01-241-4/+2
* Sort categories Makefiles.mat2019-01-231-3/+3
* Clenup xfce ports:madpilot2019-01-221-5/+6
* science/agrum: Update 0.13.4 -> 0.13.6yuri2019-01-223-11/+10
* science/gromacs: Update 2018.4 -> 2019yuri2019-01-223-18/+17
* science/spglib: Update 1.11.2 -> 1.11.2.1yuri2019-01-212-4/+4
* science/octopus: patchesyuri2019-01-202-0/+21
* science/octopus: Unbundle spglib; Add OPENMP option that makes it parallelize...yuri2019-01-202-20/+10
* science/mcstas-comps: fix RUN_DEPENDStcberner2019-01-191-1/+1
* Mark BROKEN: missing RUN_DEPENDSantoine2019-01-191-0/+2
* science/erkale: Update 0c285c1 -> 4bd3930yuri2019-01-192-5/+5
* science/py-rmsd: Fix CATEGORIESyuri2019-01-181-1/+1
* New port: science/py-rmsd: Calculate root-mean-square deviation (RMSD) betwee...yuri2019-01-184-0/+33
* Add py-asdf 2.3.1sunpoet2019-01-184-0/+47
* New port: science/erkale-pseudopotentials: Pseudopotentials for Erkale, the q...yuri2019-01-175-0/+316
* science/erkale: Update 0927d8c -> 0c285c1yuri2019-01-173-7/+14
* science/py-OpenFermion: Update 0.8 -> 0.9.0yuri2019-01-172-6/+4
* science/lm: Do not set VMD_VARS twiceyuri2019-01-171-2/+1
* science/coot: Remove the unused CONFIGURE_ARGS lineyuri2019-01-171-2/+1
* science/vipster: Update 1.14a -> 1.14.1ayuri2019-01-172-5/+4
* Fix Qt5 symbol version scripts to put the catch-all clause first. Whentijl2019-01-16