freebsd-ports/science
2018-10-25 07:36:58 +00:00
..
2d-rewriter
abinit
afni Add DOCS options to ports that should have one. 2018-09-10 13:14:50 +00:00
aircraft-datcom Add DOCS options to ports that should have one. 2018-09-10 13:14:50 +00:00
ALPSCore Update science/hdf5 to 1.10.2 2018-09-05 22:05:23 +00:00
antioch Upgrade these ports to USES=compiler:c++11-lang to fix build on gcc-based 2018-09-18 09:28:34 +00:00
atom science/libxc: Update 3.0.0 -> 4.2.3 2018-10-20 23:29:28 +00:00
atompaw science/atompaw: Update 4.1.0.3 -> 4.1.0.4 2018-09-20 15:00:46 +00:00
avogadro science/avogadro: Add CONFLICTS statement 2018-10-24 06:03:32 +00:00
avogadro2 science/avogadrolibs: Update 1.91.0 -> 1.91.0-107 2018-10-18 22:31:26 +00:00
avogadrolibs science/avogadrolibs: Update 1.91.0 -> 1.91.0-107 2018-10-18 22:31:26 +00:00
bagel science/libxc: Update 3.0.0 -> 4.2.3 2018-10-20 23:29:28 +00:00
bddsolve Fix build on gcc-based archs by updating USES. 2018-09-22 05:30:31 +00:00
bft
bodr
brian
buddy
cdcl Add EXAMPLES options to ports that should have one. 2018-09-10 13:15:47 +00:00
cdf
cdo Update science/hdf5 to 1.10.2 2018-09-05 22:05:23 +00:00
cgnslib science/cgnslib: Update to 3.3.1 and modernize 2018-10-18 00:27:01 +00:00
cgribex
checkmol
chemical-mime-data
chemps2 science/chemps2: Update 1.8.7 -> 1.8.8 2018-09-28 03:25:20 +00:00
chemtool science/chemtool: fix build with GCC-based architectures 2018-10-20 16:21:13 +00:00
chemtool-devel
chrono Update science/hdf5 to 1.10.2 2018-09-05 22:05:23 +00:00
clhep Previous commit unbroke on powerpc64. 2018-09-18 08:21:26 +00:00
clipper science/clipper: Update 2.1.20180526 -> 2.1.20180802 2018-09-27 03:50:55 +00:00
colt
coordgenlibs New port: science/coordgenlibs: Schrodinger-developed 2D coordinate generation 2018-10-25 07:36:58 +00:00
coot Cleanup plists 2018-10-01 09:36:38 +00:00
cp2k science/cp2k: Change from net/mpich2 -> net/mpich 2018-09-23 00:25:19 +00:00
crf++
dalton
datawarrior
dcl
devisor
dft_tools Mark BROKEN: wrong LIB_DEPENDS 2018-09-27 05:26:32 +00:00
dftbplus science/dftbplus science/mbdyn science/octopus: Change from math/arpack to math/arpack-ng 2018-10-04 21:10:42 +00:00
dkh
dlib-cpp
dlpoly-classic
eccodes Update MASTER_SITES and WWW 2018-09-06 18:23:25 +00:00
ecs Update science/hdf5 to 1.10.2 2018-09-05 22:05:23 +00:00
elk New port: science/elk: All-electron full-potential linearised augmented-planewave code 2018-09-23 08:43:32 +00:00
epte
erd
erkale New port: science/erkale: Quantum chemistry program to solve the electronic structure of atoms 2018-10-21 17:56:11 +00:00
fastcap
fasthenry
fisicalab Update Objective-C LLVM version to 6.0. 2018-09-26 15:23:37 +00:00
fleur Change 20 ports from net/mpich2 to net/mpich 2018-09-22 16:36:38 +00:00
fsom science/fsom: Fix build on GCC-based architectures 2018-09-30 21:41:44 +00:00
fvcom
fvcom-mpi
fvm science/fvm: Change from net/mpich2 to net/mpich 2018-10-02 21:38:06 +00:00
gabedit Change x11/xorgproto to become a build dep 2018-09-11 18:34:27 +00:00
gamess-us science/gamess-us: Cosmetic change: internal version number change to 00 for convenence because it is a default 2018-10-15 06:12:03 +00:00
gchemutils
gdma
getdp - Update to 3.0.3. 2018-10-24 14:36:09 +00:00
ghemical
ghmm
gnudatalanguage science/gnudatalanguage: Change from net/mpich2 to net/mpich 2018-10-02 21:54:14 +00:00
gramps
grib_api Update to 1.27.0 2018-09-06 18:23:31 +00:00
gromacs Change 20 ports from net/mpich2 to net/mpich 2018-09-22 16:36:38 +00:00
gsmc
gtamsanalyzer Update Objective-C LLVM version to 6.0. 2018-09-26 15:23:37 +00:00
gwyddion Update ilmbase and openexr to 2.3.0, rename OpenEXR to openexr. 2018-09-22 10:15:22 +00:00
h5utils Update science/hdf5 to 1.10.2 2018-09-05 22:05:23 +00:00
harminv
hdf
hdf5 Update science/hdf5 to 1.10.2 2018-09-05 22:05:23 +00:00
hdf5-18
hypre science/hypre: Update 2.15.0 -> 2.15.1 2018-10-20 15:47:07 +00:00
iboview Change x11/xorgproto to become a build dep 2018-09-11 18:34:27 +00:00
InsightToolkit Update science/hdf5 to 1.10.2 2018-09-05 22:05:23 +00:00
isaac-cfd
jdftx science/libxc: Update 3.0.0 -> 4.2.3 2018-10-20 23:29:28 +00:00
jstrack Add DOCS options to ports that should have one. 2018-09-10 13:14:50 +00:00
kalzium Update KDE Applications to 18.08.2 2018-10-11 20:23:50 +00:00
kalzium-kde4
kst2
lammps New port: science/lammps: Classical molecular dynamics code with a focus on materials modeling 2018-09-06 06:31:27 +00:00
lamprop
libaec
libccp4
libcint
libctl
libefp
libgeodecomp
libghemical
libgridxc science/libxc: Update 3.0.0 -> 4.2.3 2018-10-20 23:29:28 +00:00
libint
libint2
libkml
liblinear
libmsym New port: science/libmsym: Molecular point group symmetry library 2018-10-16 22:58:17 +00:00
liboglappth
libquantum
libssm
libsvm - Update pkg-descr 2018-10-13 14:26:24 +00:00
libsvm-python
libxc science/libxc: Update 3.0.0 -> 4.2.3 2018-10-20 23:29:28 +00:00
linsmith Deprecate some GNOME 2 applications 2018-10-07 20:25:16 +00:00
lm Change 20 ports from net/mpich2 to net/mpich 2018-09-22 16:36:38 +00:00
luscus Sscience/luscus: Update 0.8.5 -> 0.8.6 2018-10-18 07:30:25 +00:00
madness science/libxc: Update 3.0.0 -> 4.2.3 2018-10-20 23:29:28 +00:00
maeparser New port: science/maeparser: Parser for Schrodinger Maestro files 2018-10-25 07:24:36 +00:00
massxpert
mbdyn science/dftbplus science/mbdyn science/octopus: Change from math/arpack to math/arpack-ng 2018-10-04 21:10:42 +00:00
mcstas
mcstas-comps
mcxtrace
mcxtrace-comps
mdynamix Change 20 ports from net/mpich2 to net/mpich 2018-09-22 16:36:38 +00:00
medit
meep Update science/hdf5 to 1.10.2 2018-09-05 22:05:23 +00:00
mei
metaf2xml
metaphysicl science/metaphysicl: Update 0.3.0.1 -> 0.3.1 2018-10-18 21:28:46 +00:00
minc2 Update science/hdf5 to 1.10.2 2018-09-05 22:05:23 +00:00
mmdb2
mmtf New port: science/mmtf: C++ implementation of the MMTF API, decoder and encoder 2018-10-18 21:21:17 +00:00
mol2ps
molgif New port: science/molgif: Tool to create GIF animations of molecules 2018-10-07 21:54:19 +00:00
molsketch New port: science/molsketch: 2D molecule editor 2018-10-24 05:36:11 +00:00
MOOSE-neural-simulator Update science/hdf5 to 1.10.2 2018-09-05 22:05:23 +00:00
mpb Update science/hdf5 to 1.10.2 2018-09-05 22:05:23 +00:00
mpqc science/mpqc: Add -lmpich to LDFLAGS: this fixes science/libghemical build 2018-09-07 02:23:54 +00:00
msms science/msms: Add back NO_WRKSUBDIR 2018-09-10 07:09:49 +00:00
multiwfn
namd science/namd: Remove RESTRICTED because LICENSE_PERMS is restrictive 2018-09-10 06:59:36 +00:00
ncs Mark BROKEN: conflicting dependencies 2018-10-06 21:10:46 +00:00
netcdf Update science/hdf5 to 1.10.2 2018-09-05 22:05:23 +00:00
netcdf-cxx
netcdf-fortran
nifticlib
nwchem science/nwchem: Update 6.8.1-release-94 -> 6.8.1-release-144 2018-10-09 01:28:07 +00:00
octopus science/libxc: Update 3.0.0 -> 4.2.3 2018-10-20 23:29:28 +00:00
openbabel
openkim
openmx Change 20 ports from net/mpich2 to net/mpich 2018-09-22 16:36:38 +00:00
openstructure Change x11/xorgproto to become a build dep 2018-09-11 18:34:27 +00:00
p5-Algorithm-SVMLight
p5-Chemistry-3DBuilder
p5-Chemistry-Bond-Find - Add LICENSE 2018-10-09 09:08:39 +00:00
p5-Chemistry-Canonicalize - Add LICENSE 2018-10-05 09:08:36 +00:00
p5-Chemistry-Elements
p5-Chemistry-File-MDLMol
p5-Chemistry-File-Mopac
p5-Chemistry-File-PDB Fix every instance of RUN_DEPENDS:=${BUILD_DEPENDS} in p5 ports, except 2018-10-06 13:06:42 +00:00
p5-Chemistry-File-SLN
p5-Chemistry-File-SMARTS
p5-Chemistry-File-SMILES
p5-Chemistry-File-VRML
p5-Chemistry-File-XYZ
p5-Chemistry-FormulaPattern
p5-Chemistry-InternalCoords
p5-Chemistry-Isotope
p5-Chemistry-MacroMol Fix every instance of RUN_DEPENDS:=${BUILD_DEPENDS} in p5 ports, except 2018-10-06 13:06:42 +00:00
p5-Chemistry-MidasPattern
p5-Chemistry-Mok
p5-Chemistry-Mol Fix every instance of RUN_DEPENDS:=${BUILD_DEPENDS} in p5 ports, except 2018-10-06 13:06:42 +00:00
p5-Chemistry-Pattern
p5-Chemistry-Reaction
p5-Chemistry-Ring
p5-Geo-BUFR Remove MASTER_SITE_SUBDIR 2018-09-10 20:27:04 +00:00
p5-Geo-Coordinates-Converter Fix every instance of RUN_DEPENDS:=${BUILD_DEPENDS} in p5 ports, except 2018-10-06 13:06:42 +00:00
p5-Geo-Coordinates-Converter-iArea Fix every instance of RUN_DEPENDS:=${BUILD_DEPENDS} in p5 ports, except 2018-10-06 13:06:42 +00:00
p5-Geo-ReadGRIB
p5-Geo-WebService-Elevation-USGS - Update to 0.110 2018-10-10 01:38:11 +00:00
p5-Mcstas-Tools
p5-PerlMol
p5-Physics-Unit
paje Update Objective-C LLVM version to 6.0. 2018-09-26 15:23:37 +00:00
paraview Cleanup plist 2018-10-01 06:30:37 +00:00
pcmsolver
PETSc science/PETSc: Update 3.10.1 -> 3.10.2 2018-10-20 16:08:58 +00:00
pnetcdf Change from MPICH2 to MPICH option 2018-09-24 11:14:24 +00:00
psychopy
pulseview
py-abipy
py-ase Never use ${FLAVOR} directly in dependencies, FLAVOR is not transitive. 2018-09-14 12:19:48 +00:00
py-avogadrolibs New port: science/py-avogadrolibs: Python bindings for Avogadro2 chemistry libraries 2018-10-21 17:52:35 +00:00
py-cdo Update to 1.4.0 2018-09-20 19:27:39 +00:00
py-chempy science/py-chempy: Update 0.7.4 -> 0.7.5 2018-10-20 15:48:32 +00:00
py-coards
py-DendroPy Fix packaging with python 3.x 2018-10-12 14:58:58 +00:00
py-dlib
py-gpaw science/libxc: Update 3.0.0 -> 4.2.3 2018-10-20 23:29:28 +00:00
py-gsd science/py-gsd: Update 1.5.3 -> 1.5.4 2018-10-06 04:09:31 +00:00
py-h5py Update science/hdf5 to 1.10.2 2018-09-05 22:05:23 +00:00
py-hcluster
py-kinematics
py-MDAnalysis science/py-MDAnalysis: Update 0.18.0 -> 0.19.0 2018-10-12 01:15:42 +00:00
py-MDAnalysisTests science/py-MDAnalysisTests: Update 0.18.0 -> 0.19.0 2018-10-12 01:16:48 +00:00
py-mdp
py-mlpy
py-mmtf-python
py-molmod New port: science/py-molmod: Collection of molecular modelling tools for python 2018-09-14 03:10:59 +00:00
py-netCDF4 Update science/hdf5 to 1.10.2 2018-09-05 22:05:23 +00:00
py-obspy
py-OpenFermion
py-openpiv
py-paida
py-phono3py New port: science/py-phono3py: Software to calculate phonon-phonon interaction and related properties 2018-09-14 05:37:12 +00:00
py-phonopy science/py-phonopy: Fix tests 2018-10-17 07:04:50 +00:00
py-pupynere
py-pyaixi
py-pydicom - Update to 1.2.0 2018-10-08 12:03:51 +00:00
py-PyFR science/py-PyFR: Update 1.7.6 -> 1.8.0 2018-10-17 07:27:27 +00:00
py-pymatgen science/py-pymatgen: Update 2018.8.10 -> 2018.9.1 2018-09-17 20:29:11 +00:00
py-pymol science/py-pymol: Update 2.1.0 -> 2.2.0 2018-09-17 20:48:45 +00:00
py-pyosf
py-PyQuante
py-pysal
py-pyteomics
py-pyteomics.biolccc
py-qspin
py-quantities
py-rmf
py-ScientificPython
py-scikit-fuzzy science/py-scikit-fuzzy: Update 0.3.1 -> 0.4.0 2018-10-19 04:43:52 +00:00
py-scikit-learn
py-scikit-sparse
py-scimath
py-scipy Update MASTER_SITES 2018-10-06 09:27:12 +00:00
py-scoria
py-SimpleSpectral
py-spglib science/py-spglib: Update 1.10.4.1 -> 1.10.4.11 2018-09-19 18:35:55 +00:00
py-veusz
py-ws2300
pybrain
pycdf
pynn
qbox Change 20 ports from net/mpich2 to net/mpich 2018-09-22 16:36:38 +00:00
qcl
qmcpack Change 20 ports from net/mpich2 to net/mpich 2018-09-22 16:36:38 +00:00
qtresistors
quantum-espresso Change 20 ports from net/mpich2 to net/mpich 2018-09-22 16:36:38 +00:00
qwalk
R-cran-AMORE
R-cran-bayesm
R-cran-cmprsk
R-cran-DCluster
R-cran-e1071
R-cran-eco
R-cran-Epi
R-cran-epicalc
R-cran-etm
R-cran-fastICA
R-cran-kernlab
R-cran-snow - Update to 0.4-3 2018-09-18 06:51:54 +00:00
R-cran-som
R-cran-udunits2
rdkit science/rdkit: Update 2018_03_4 -> 2018_09_1 2018-10-25 07:00:51 +00:00
rmf Update science/hdf5 to 1.10.2 2018-09-05 22:05:23 +00:00
rubygem-ai4r
rubygem-cdo Update to 1.4.0 2018-09-20 19:28:05 +00:00
rubygem-rgeo Update to 1.1.2 2018-10-11 23:45:49 +00:00
rubygem-rgeo-geojson
rubygem-rgeo-proj4
rubygem-rgeo-shapefile
rubygem-ruby-dcl
rubygem-ruby-netcdf
siesta
sigrok-cli
sigrok-firmware
sigrok-firmware-fx2lafw Add DOCS options to ports that should have one. 2018-09-10 13:14:50 +00:00
sigrok-firmware-utils Add DOCS options to ports that should have one. 2018-09-10 13:14:50 +00:00
silo Update science/hdf5 to 1.10.2 2018-09-05 22:05:23 +00:00
simint science/simint: Update 0.7 -> 0.8 2018-10-11 03:21:01 +00:00
simlib science/simlib: Update 3.02 -> 3.06 2018-10-19 05:38:42 +00:00
simsmith
spglib
step Update KDE Applications to 18.08.2 2018-10-11 20:23:50 +00:00
step-kde4
svmlight
szip
teem
tfel
tinker biology/tinker: Update 7.1.3 -> 8.4.4; Move to science/ 2018-10-07 00:19:22 +00:00
triqs Mark BROKEN: wrong LIB_DEPENDS 2018-09-27 05:26:32 +00:00
udunits
v_sim
vmd science/vmd: Remove RESTRICTED: not required 2018-09-10 07:06:17 +00:00
voro++
wannier90
wxmacmolplt New port: science/wxmacmolplt: Graphical user interface principally for the GAMESS program 2018-10-14 23:15:09 +00:00
xcrysden
xdrawchem Change x11/xorgproto to become a build dep 2018-09-11 18:34:27 +00:00
xfce4-equake-plugin
xmakemol
Makefile New port: science/coordgenlibs: Schrodinger-developed 2D coordinate generation 2018-10-25 07:36:58 +00:00