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mirror of https://git.FreeBSD.org/ports.git synced 2024-12-07 02:06:57 +00:00
freebsd-ports/science
Yuri Victorovich 2bf7fa55b0 science/py-cirq-google: Update 0.12.0 -> 0.13.0
Reported by:	portscout
2021-10-17 08:49:41 -07:00
..
2d-rewriter
abinit
afni science/afni: update to 21.3.00 2021-10-11 18:20:11 +02:00
agrum science/agrum: Update 0.22.0 -> 0.22.1 2021-09-13 15:28:57 -07:00
aircraft-datcom
ALPSCore
antioch
apbs
ascent science/ascent: New port: Visualization and analysis runtime for multi-physics HPC simulations 2021-09-16 09:46:15 -07:00
atompaw
avogadro2
avogadrolibs science/[,py-]spglib: Update 1.16.1 -> 1.16.2 2021-08-15 18:32:15 -07:00
axom science/axom: Add dependencies 2021-09-18 12:37:10 -07:00
bagel
bddsolve
berkeleygw
bodr
buddy
cantera science/cantera: Fix handling of Python versions 2021-09-19 20:08:25 -07:00
cdcl
cdf
cdk
cdo
cgnslib
cgribex
checkmol
chemical-mime-data INSTALLS_ICONS: retire the macro and rework the related dependencies 2021-10-10 21:44:42 +02:00
chemps2
chemtool
chemtool-devel
chrono
clhep
clipper
code_saturne
colt
conduit science/conduit: Add dependencies 2021-09-16 12:48:34 -07:00
coordgenlibs science/coordgenlibs: Update 2.0.3 -> 3.0.0 2021-09-09 13:00:09 -07:00
cp2k
cp2k-data
crf++
csvtk
dakota
dalton
dcl
devisor
dftbplus
dkh
dlib-cpp
drawxtl
dvc
dynare science/dynare: fix build on non-amd64 64-bit architectures 2021-10-08 01:25:19 +00:00
eccodes science/eccodes: Update to 2.23.0 2021-09-22 06:23:22 +08:00
elk
elmerfem
epte *: Return culot@'s ports to the pool (and perl@) after safekeeping his bit. 2021-09-06 23:13:27 +02:00
erd
ergo
erkale math/armadillo: Update to 10.6.2 2021-09-21 10:25:15 +01:00
erkale-pseudopotentials
fastcap
fasthenry
fastjet
fisicalab
frontistr
fsom
fvcom
fvcom-mpi *: Clean up some things 2021-10-12 17:01:38 +02:00
gabedit INSTALLS_ICONS: retire the macro and rework the related dependencies 2021-10-10 21:44:42 +02:00
gamess-us
gchemutils INSTALLS_ICONS: retire the macro and rework the related dependencies 2021-10-10 21:44:42 +02:00
gdma
getdp science/getdp: Update to 3.4.0. 2021-09-24 12:35:11 -05:00
ghemical
ghmm
gnudatalanguage
gpaw-setups
gramps INSTALLS_ICONS: retire the macro and rework the related dependencies 2021-10-10 21:44:42 +02:00
grib_api
gromacs science/gromacs: Update 2021.2 -> 2021.3 2021-08-19 11:04:44 -07:00
gsmc
gtamsanalyzer
h5utils
h5z-zfp
harminv
hdf
hdf5 science/hdf5: Add CPE information 2021-10-14 12:26:24 +02:00
hdf5-18 science/hdf5-18: Add CPE information 2021-10-14 12:26:39 +02:00
healpix
helfem math/armadillo: Update to 10.6.2 2021-09-21 10:25:15 +01:00
hepmc3
highfive
hypre science/hypre: Update 2.22.1 -> 2.23.0 2021-10-07 11:43:15 -07:00
iboview
InsightToolkit
isaac-cfd
jdftx
jmol science/jmol: Update 14.31.53 -> 14.31.57 2021-10-06 09:11:50 -07:00
jstrack
kalzium KDE: Update KDE Gear to 21.08.2 2021-10-07 22:48:21 +02:00
kim-api many: Depend on vim instead of vim-console 2021-09-02 12:09:29 -06:00
kst2
lammps science/lammps: Update patch_2Jul2021 -> stable_29Sep2021 2021-09-30 10:30:10 -07:00
lamprop
latte
libaec science/libaec: Update to 1.0.6 2021-09-28 03:48:08 +08:00
libccp4
libcint science/libcint: Update 4.4.4 -> 4.4.6 2021-10-16 15:21:14 -07:00
libctl
libecpint
libefp
libgeodecomp
libghemical science/libghemical: Remove LD_PRELOAD vecause it configured now without it 2021-09-26 10:43:55 -07:00
libgridxc
libint
libint2
libkml
liblinear
libmsym
liboglappth *: fix tab vs. space issues, and comments according to the guide. 2021-10-16 11:51:39 +02:00
libquantum
libssm
libsvm *: Clean up some things 2021-10-12 17:01:38 +02:00
libsvm-python
libvdwxc
libxc
liggghts
luscus
madness
maeparser
massxpert
mbdyn
mcstas
mcstas-comps
mcxtrace
mcxtrace-comps
mdynamix
medit
metaphysicl
minc2
mmdb2
mmtf-cpp
mol2ps
molgif
molscript
molsketch
mpb
mpqc
msms
multiwfn
namd
nest
netcdf
netcdf-cxx
netcdf-fortran
nifticlib
nwchem science/nwchem: Mark as broken on aarch64. 2021-09-26 10:25:25 +02:00
nwchem-data
octopus science/[,py-]spglib: Update 1.16.1 -> 1.16.2 2021-08-15 18:32:15 -07:00
openbabel science/coordgenlibs: Update 2.0.3 -> 3.0.0 2021-09-09 13:00:09 -07:00
openems science/openems: fix build on powerpc64* 2021-10-01 14:39:19 +00:00
openkim
openkim-models many: Depend on vim instead of vim-console 2021-09-02 12:09:29 -06:00
openmc science/openmc: Unbreak LIBMESH option by switching to mpich 2021-10-12 13:52:17 -07:00
openmx science/openmx: Cleanup - remove unnecessary lines 2021-09-05 10:00:44 -07:00
opensim-core
opensph devel/onetbb: Update to 2021.4.0 2021-10-10 17:11:27 +02:00
opsin
orthanc cience/orthanci: Update to 1.9.7 2021-10-17 15:18:34 +08:00
orthanc-dicomweb science/orthanc-dicomweb: Update to 1.7 2021-10-15 13:36:17 +01:00
orthanc-mysql science/orthanc-mysql: Update to 4.3 2021-10-15 10:48:25 +01:00
orthanc-postgresql
orthanc-webviewer
p5-Algorithm-SVMLight
p5-Chemistry-3DBuilder
p5-Chemistry-Bond-Find
p5-Chemistry-Canonicalize
p5-Chemistry-Elements
p5-Chemistry-File-MDLMol
p5-Chemistry-File-Mopac
p5-Chemistry-File-PDB
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
p5-Chemistry-MidasPattern
p5-Chemistry-Mok
p5-Chemistry-Mol
p5-Chemistry-Pattern
p5-Chemistry-Reaction
p5-Chemistry-Ring
p5-Geo-BUFR
p5-Geo-Coordinates-Converter
p5-Geo-Coordinates-Converter-iArea
p5-Geo-WebService-Elevation-USGS
p5-Mcstas-Tools
p5-PerlMol
p5-Physics-Unit *: Return culot@'s ports to the pool (and perl@) after safekeeping his bit. 2021-09-06 23:13:27 +02:00
packmol
pagmo2 devel/onetbb: Update to 2021.4.0 2021-10-10 17:11:27 +02:00
paje
pcmsolver
PETSc
phonopy
plumed many: Depend on vim instead of vim-console 2021-09-02 12:09:29 -06:00
pnetcdf
pulseview INSTALLS_ICONS: retire the macro and rework the related dependencies 2021-10-10 21:44:42 +02:00
py-abipy
py-access
py-asdf
py-ase
py-avogadrolibs
py-cdo
py-chainer
py-chainer-chemistry
py-chempy science/py-chempy: Update 0.8.1 -> 0.8.2 2021-09-21 10:47:02 -07:00
py-cirq-aqt
py-cirq-core
py-cirq-google science/py-cirq-google: Update 0.12.0 -> 0.13.0 2021-10-17 08:49:41 -07:00
py-cirq-ionq
py-cirq-pasqal
py-coards
py-DendroPy
py-dipy
py-dlib
py-eccodes
py-esda science/py-esda: Add SHAPE option 2021-09-21 11:44:54 +08:00
py-geolinks
py-geomet
py-geometer
py-geometric
py-gpaw
py-GPy
py-GPyOpt
py-gsd science/py-gsd: Update 2.4.2 -> 2.5.0 2021-10-14 13:08:01 -07:00
py-h5json
py-h5py science/py-h5py: Update version requirement of BUILD_DEPENDS 2021-09-27 23:56:01 +08:00
py-hiphive
py-inequality
py-jupyter_jsmol
py-kim-query
py-kinematics
py-kliff
py-liac-arff
py-libpysal
py-lifelines
py-MDAnalysis
py-MDAnalysisTests
py-mdp
py-mmtf-python
py-molmod
py-moltemplate
py-netCDF4 science/py-netCDF4: Update version 1.3.1=>1.5.7 2021-10-10 10:32:52 -05:00
py-netcdf-flattener
py-nibabel
py-nilearn science/py-nilearn: Update 0.8.0 -> 0.8.1 2021-09-18 10:48:28 -07:00
py-obspy
py-oddt
py-OpenFermion
py-OpenMC science/py-OpenMC: New port: Monte Carlo neutron and photon transport simulation code (Python) 2021-10-11 08:51:36 -07:00
py-openpiv
py-paida
py-paramz
py-phono3py
py-phonopy
py-PubChemPy
py-pupynere
py-pyaixi
py-pyberny science/py-pyberny: New port: Optimizer of molecular geometries with respect to the total energy 2021-10-16 16:56:19 -07:00
py-pycsw science/py-pycsw: Add CPE information 2021-10-14 23:30:52 +02:00
py-pydicom science/py-pydicom: Update to 2.2.2 2021-10-12 14:58:13 +08:00
py-PyFR
py-pygeodesy science/py-pygeodesy: Update to 21.9.16 2021-09-22 06:23:38 +08:00
py-pygeometa science/py-pygeometa: Update to 0.8.0 2021-09-21 11:44:55 +08:00
py-pygmo2
py-pyked science/py-pyked: New port: Package for manipulating Chemical Kinetics Experimental Data files 2021-09-11 00:13:16 -07:00
py-pymatgen science/py-pymatgen: Update 2022.0.12 -> 2022.0.14 2021-10-16 16:56:17 -07:00
py-pymol
py-PyNE science/py-PyNE: Add the moab dependency; Install the nuc_data.h5 file; Build in parallel 2021-10-10 11:49:56 -07:00
py-pyosf
py-pysal science/py-pysal: Update to 2.5.0 2021-09-19 14:00:21 +08:00
py-pyscf
py-pyteomics science/py-pyteomics: Update to 4.5 2021-09-22 06:23:38 +08:00
py-qcelemental science/py-qcelemental: Update 0.22.0 -> 0.23.0; Add test target 2021-10-16 16:56:18 -07:00
py-qcengine science/py-qcengine: Update 0.19.0 -> 0.20.1; Add test target 2021-10-16 16:56:19 -07:00
py-qspin
py-quantities science/py-quantities: Update 0.12.4 -> 0.12.5 2021-08-17 12:10:45 -07:00
py-rmf
py-rmsd
py-ruffus
py-scikit-fuzzy
py-scikit-learn
py-scikit-optimize
py-scikit-sparse science/py-scikit-sparse: Update 0.4.5 -> 0.4.6 2021-09-13 15:28:57 -07:00
py-scimath
py-scipy science/py-scipy: Add CPE information 2021-08-31 09:23:26 +00:00
py-scoria
py-segregation science/py-segregation: Update to 2.1.0 2021-09-21 11:44:55 +08:00
py-segyio science/py-segyio: Fix tests 2021-08-16 00:06:30 -07:00
py-SimpleSpectral
py-skrebate
py-spaghetti science/py-spaghetti: Update to 1.6.4 2021-09-27 23:56:01 +08:00
py-spglib science/[,py-]spglib: Update 1.16.1 -> 1.16.2 2021-08-15 18:32:15 -07:00
py-tensorflow science/py-tensorflow: Add CPE information 2021-10-14 12:27:47 +02:00
py-tobler
py-veusz
pybrain
pynn
qbox science/qbox: 1.73.2 -> 1.73.3 2021-08-20 22:56:24 -07:00
qcl
qiskit-aer
qmcpack
quantum-espresso
quantum-espresso-pseudopotentials
qwalk
R-cran-AMORE
R-cran-bayesm
R-cran-cmprsk
R-cran-DCluster
R-cran-e1071 science/R-cran-e1071: Update to 1.7-9 2021-09-18 13:18:14 +00:00
R-cran-eco
R-cran-Epi
R-cran-epicalc
R-cran-etm
R-cran-FAdist
R-cran-fastICA science/R-cran-fastICA: Update to 1.2-3 2021-09-25 18:13:13 -04:00
R-cran-kernlab
R-cran-snow
R-cran-som
R-cran-udunits2
rdkit science/coordgenlibs: Update 2.0.3 -> 3.0.0 2021-09-09 13:00:09 -07:00
rmf
rubygem-ai4r
rubygem-cdo
rubygem-rgeo
rubygem-rgeo-geojson
rubygem-rgeo-proj4 science/rubygem-rgeo-proj4: Update to 3.1.0 2021-10-14 03:17:26 +08:00
rubygem-rgeo-shapefile
rubygem-ruby-dcl
rubygem-ruby-netcdf
scidavis
segyio science/segyio: Update 1.9.6 -> 1.9.7 2021-08-15 13:34:50 -07:00
shelxle science/shelxle: Update 1.0.1328 -> 1.0.1330 2021-10-16 16:56:16 -07:00
siconos cleanup: drop support for EOL FreeBSD 11.X 2021-09-30 23:23:30 +02:00
siesta
sigrok-cli INSTALLS_ICONS: retire the macro and rework the related dependencies 2021-10-10 21:44:42 +02:00
sigrok-firmware
sigrok-firmware-fx2lafw
sigrok-firmware-utils
silo
simbody
simgrid science/simgrid: Update 3.27 -> 3.28 2021-08-16 00:06:31 -07:00
simint
simlib
simsmith
smoldyn
sparta
spglib science/[,py-]spglib: Update 1.16.1 -> 1.16.2 2021-08-15 18:32:15 -07:00
step KDE: Update KDE Gear to 21.08.2 2021-10-07 22:48:21 +02:00
svmlight
szip
teem
tfel
tfel-edf
thermofun
tinker science/tinker: Update 8.9.5 -> 8.10.1 2021-10-11 08:51:36 -07:00
udunits
v_sim INSTALLS_ICONS: retire the macro and rework the related dependencies 2021-10-10 21:44:42 +02:00
vipster
vmd
voro++
votca science/votca: Update 2021.2 -> 2021.2-18560 2021-09-28 17:49:03 -07:00
wannier90
wwplot
wxmacmolplt
xcfun
xcrysden
xdrawchem
xtb
yoda science/yoda: Update 1.9.0 -> 1.9.1 2021-09-12 10:27:25 -07:00
Makefile science/py-pyberny: New port: Optimizer of molecular geometries with respect to the total energy 2021-10-16 16:56:19 -07:00