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mirror of https://git.FreeBSD.org/ports.git synced 2024-11-19 00:13:33 +00:00
freebsd-ports/science
Yuri Victorovich 8906117a65 science/py-abipy: Update 0.9.0 → 0.9.1
Reported by:	portscout
2023-06-25 13:46:02 -07:00
..
2d-rewriter
abinit science/abinit: Update 9.6.2 → 9.8.4 2023-06-12 17:41:20 -07:00
afni science/afni: update to 23.1.09 2023-06-25 18:05:46 +02:00
agrum
aircraft-datcom
ALPSCore
antioch
apbs
arbor
ascent
atompaw
avogadro2
avogadrolibs
axom
bagel
bddsolve
berkeleygw
bodr
bout++
bout++-merging-filaments
buddy
cantera science/cantera: Add USES=localbase in an attempt to fix build on various systems 2023-06-06 21:45:24 -07:00
cardioid
cdf
cdk
cdo
cgnslib science/cgnslib: Fix build with llvm16 2023-06-23 21:30:40 +02:00
cgribex
checkmol
chemical-mime-data
chemicalfun
chemps2
chemtool
chemtool-devel
chimes-calculator
ChipmunkPhysics
chrono
cif-tools science/cif-tools: Update 1.0.8 → 1.0.9 2023-06-08 22:26:58 -07:00
clhep
clipper
code_saturne science/hypre: Update 2.28.0 → 2.29.0 2023-06-25 01:26:02 -07:00
colt
conduit
coordgenlibs
cp2k
cp2k-data
crf++
csvtk
dakota
dalton
dd_package
devisor
dftbplus science/dftbplus: Update 22.1 → 22.2 2023-06-04 13:30:53 -07:00
dftd3
dftd4 science/dftd4: Update 3.4.0 → 3.5.0 2023-06-18 11:43:47 -07:00
dimod science/dimod: Update 0.12.3 → 0.12.7 2023-06-18 11:30:41 -07:00
dirac
dkh
dlib-cpp
drawxtl
dssp science/dssp: Update 4.3.0 → 4.3.1 2023-06-08 22:26:59 -07:00
dvc
dwave-preprocessing science/dwave-preprocessing: Update 0.4.0 → 0.5.4 2023-06-18 11:52:44 -07:00
dynare
eccodes
elk science/elk: Update 8.7.2 → 8.8.26 2023-06-18 13:42:28 -07:00
elmerfem math/vtk9: Update 9.2.2 → 9.2.6 2023-06-23 21:51:29 -07:00
epte
erd
ergo
erkale
erkale-pseudopotentials
fastcap
fasthenry
fastjet
feff10
fleur
frontistr
fsom
fvcom
fvcom-mpi
gabedit
gamess-us
gbtolib
gchemutils
gdma
geant4
gemmi science/{,py-}gemmi: Update 0.6.0 → 0.6.2 2023-05-28 16:41:04 -07:00
getdp
ghemical
ghmm science/ghmm: Fix build with llvm15 2023-06-06 19:47:39 +02:00
gnudatalanguage
gpaw-setups
gramps
grib_api
gromacs science/gromacs: Update 2022.4 → 2023.1 2023-06-13 16:21:55 -07:00
gsmc
gtamsanalyzer science/gtamsanalyzer: Fix build with llvm16 2023-06-24 14:03:42 +02:00
h5utils
h5z-zfp
harminv
hdf
hdf5
hdf5-18
hdf5-110
healpix
helfem
hepmc3
highfive
hypre science/hypre: Update 2.28.0 → 2.29.0 2023-06-25 01:26:02 -07:00
iboview
InsightToolkit math/vtk9: Update 9.2.2 → 9.2.6 2023-06-23 21:51:29 -07:00
InsightToolkit501
isaac-cfd
jdftx
jmol science/jmol: Update 16.1.11 → 16.1.13 2023-06-09 20:59:11 -07:00
jstrack
kalzium
kim-api
kplib
kst2
lammps math/vtk9: Update 9.2.2 → 9.2.6 2023-06-23 21:51:29 -07:00
lamprop
latte
libaec
libccp4
libcifpp science/libcifpp: Update 5.0.9 → 5.1.0.1 2023-06-08 22:26:58 -07:00
libcint
libctl
libecpint
libefp
libgeodecomp
libgetar
libghemical
libgridxc
libint
libint2
libint2-psi4 science/libint2-psi4: Fix fetch 2023-06-05 13:24:13 -07:00
libkml
liblinear
libmbd
libmsym
libnegf science/libnegf: Update 1.1.2 → 1.1.3 2023-06-03 00:01:40 -07:00
liboglappth
libquantum
libssm
libsvm
libsvm-python
libtensorflow1
libvdwxc
libxc
liggghts math/vtk9: Update 9.2.2 → 9.2.6 2023-06-23 21:51:29 -07:00
linux-zotero
luscus
m-aneos
madness
maeparser
massxpert
mbdyn
mcstas
mcstas-comps
mctc-lib
mcxtrace
mcxtrace-comps
mdynamix
medit
meep science/meep: Update 1.26.0 → 1.27.0 2023-05-28 16:41:05 -07:00
mercantile
metaphysicl
minc2
mmdb2
mmtf-cpp
mol2ps
molgif
molscript science/molscript: Fix build with llvm15 2023-06-06 22:45:25 +02:00
molsketch
mopac
mp2d
mpb
mpqc
mrchem
mrcpp science/mrcpp: Update 1.4.2 → 1.5.0 2023-05-28 16:41:04 -07:00
msms
mstore
multicharge
multiwfn science/multiwfn: Small corrections 2023-06-20 14:49:52 -07:00
namd
nest
netcdf
netcdf-cxx
netcdf-fortran
nifticlib
nlcglib
nwchem
nwchem-data
ocean science/ocean: Update 3.0.0 → 3.0.4 2023-06-04 11:00:07 -07:00
octopus
openbabel
openems math/vtk9: Update 9.2.2 → 9.2.6 2023-06-23 21:51:29 -07:00
openkim-models
openmc
openmodelica
openmolcas
openmx
opensim-core
opensph *: bump PORTREVISION of Imath users 2023-06-02 23:40:45 +02:00
opsin
orthanc
orthanc-dicomweb
orthanc-mysql
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-Calc
p5-Geo-Coordinates-Converter
p5-Geo-Coordinates-Converter-iArea
p5-Geo-Coordinates-Transform
p5-Geo-WebService-Elevation-USGS
p5-Mcstas-Tools
p5-PerlMol
p5-Physics-Unit
packmol
pagmo2
paje
paraview math/vtk9: Update 9.2.2 → 9.2.6 2023-06-23 21:51:29 -07:00
pastix
pcmsolver
PETSc science/PETSc: Update 3.19.1 → 3.19.2 2023-06-11 00:55:54 -07:00
phonopy
plumed
pnetcdf
polytope science/polytope: Update 0.7.0 → 0.7.3 2023-06-07 10:04:07 -07:00
precice
psi4
pulseview
py-abipy science/py-abipy: Update 0.9.0 → 0.9.1 2023-06-25 13:46:02 -07:00
py-access
py-arbor
py-arch
py-asap3
py-asdf
py-asdf-standard
py-asdf-transform-schemas
py-asdf-unit-schemas
py-ase
py-atomium
py-avogadrolibs
py-boutdata
py-boututils
py-cdo
py-cfgrib
py-chainer
py-chainer-chemistry
py-chempy
py-cirq-aqt
py-cirq-core
py-cirq-google
py-cirq-ionq
py-cirq-pasqal
py-cirq-rigetti
py-coards
py-DendroPy science/py-DendroPy: Update to 4.6.1 2023-06-13 15:30:02 +08:00
py-dftbplus science/py-dftbplus: New port: DFTB+: Package for performing fast atomistic simulations 2023-06-04 13:30:54 -07:00
py-dimod science/py-dimod: Update 0.12.4 → 0.12.7 2023-06-13 20:58:13 -07:00
py-dipy science/py-dipy: Update 1.6.0 → 1.7.0 2023-06-07 19:40:00 -07:00
py-dlib
py-dwave-cloud-client science/py-dwave-cloud-client: Update 0.10.4 → 0.10.5 2023-06-03 00:01:41 -07:00
py-dwave-greedy
py-dwave-hybrid
py-dwave-inspector science/py-dwave-inspector: Update 0.4.0 → 0.4.2 2023-06-13 20:58:14 -07:00
py-dwave-neal
py-dwave-networkx science/py-dwave-networkx: Update 0.8.13 → 0.8.14 2023-06-13 20:58:14 -07:00
py-dwave-ocean-sdk science/py-dwave-ocean-sdk: Update 6.2.0 → 6.4.0 2023-06-13 20:58:15 -07:00
py-dwave-preprocessing
py-dwave-samplers
py-dwave-system science/py-dwave-system: Update 1.18.0 → 1.20.0 2023-06-13 20:58:14 -07:00
py-dwave-tabu
py-dwavebinarycsp
py-earthpy
py-eccodes
py-esda
py-fresnel
py-gemmi science/{,py-}gemmi: Update 0.6.0 → 0.6.2 2023-05-28 16:41:04 -07:00
py-geolinks
py-geomet
py-geometer
py-geometric
py-gpaw
py-GPy
py-GPyOpt
py-gsd science/py-gsd: Update 3.0.0 → 3.0.1 2023-06-21 00:44:29 -07:00
py-h5json
py-h5py
py-HepMC3
py-hiphive
py-hoomd-blue science/py-hoomd-blue: Update 3.11.0 → 4.0.0 2023-06-11 00:55:54 -07:00
py-inequality
py-ipygany
py-jupyter_jsmol
py-kim-query
py-kimpy
py-kinematics
py-kliff
py-kpLib
py-liac-arff
py-libgetar
py-libpysal
py-lifelines
py-MDAnalysis
py-MDAnalysisTests
py-mdp
py-meshio
py-mmcif
py-mmtf-python
py-molmod
py-moltemplate
py-mrchem
py-netCDF4 science/py-netCDF4: Update version 1.6.3=>1.6.4 2023-06-06 19:47:38 +02:00
py-netcdf-flattener
py-nibabel
py-nilearn
py-obspy
py-oddt
py-openbabel
py-OpenFermion
py-OpenFermion-Dirac
py-OpenFermion-PySCF
py-OpenMC
py-openpiv
py-optking
py-paida
py-paramz
py-penaltymodel
py-phono3py
py-phonopy
py-PubChemPy
py-pupynere
py-py3Dmol
py-pyaixi
py-pyberny
py-pycsw
py-pydicom science/py-pydicom: Update to 2.4.1 2023-06-19 21:33:03 +08:00
py-PyFR
py-pygeodesy
py-pygeometa science/py-pygeometa: Update to 0.15.0 2023-05-28 07:44:08 +08:00
py-pygmo2
py-pyked
py-pymatgen
py-pymbd
py-pymol
py-PyNE
py-pyosf
py-pyprecice
py-pyqubo
py-pysal
py-pyscf
py-pyteomics
py-qcelemental
py-qcengine
py-qiskit science/py-qiskit: Update 0.37.2 → 0.43.1 2023-06-18 10:56:50 -07:00
py-qiskit-aer science/py-qiskit-aer: Update 0.10.4 → 0.12.1 2023-06-18 10:56:50 -07:00
py-qiskit-dynamics science/py-qiskit-dynamics: Update 0.4.0 → 0.4.1 2023-06-10 22:19:33 -07:00
py-qiskit-experiments science/py-qiskit-experiments: Update 0.5.0 → 0.5.2 2023-06-18 10:56:49 -07:00
py-qiskit-finance
py-qiskit-ibm-experiment science/py-qiskit-ibm-experiment: Update 0.2.5 → 0.3.3 2023-06-18 10:56:48 -07:00
py-qiskit-ibm-provider science/py-qiskit-ibm-provider: Update g20220804 → 0.6.1 2023-06-18 10:56:48 -07:00
py-qiskit-ibmq-provider science/py-qiskit-ibmq-provider: Update 0.19.2 → 0.20.2 2023-06-18 10:56:48 -07:00
py-qiskit-nature science/py-qiskit-nature: Update 0.4.5 → 0.6.2 2023-06-18 10:56:49 -07:00
py-qiskit-optimization
py-qiskit-terra science/py-qiskit-terra: Update 0.23.3 → 0.24.1 2023-06-18 10:56:47 -07:00
py-qspin science/py-qspin: Update 2.3.2 → 2.3.3 2023-06-19 00:49:00 -07:00
py-quantities science/py-quantities: Update 0.13.0 → 0.14.1 2023-06-18 22:40:38 -07:00
py-rmf science/{,py-}rmf: Update 1.5.0 → 1.5.1 2023-06-18 11:23:36 -07:00
py-rmsd
py-ruffus
py-scikit-fuzzy
py-scikit-learn
py-scikit-optimize
py-scikit-sparse science/py-scikit-sparse: Update 0.4.6 → 0.4.8 2023-06-18 22:40:38 -07:00
py-scimath
py-scipy science/py-scipy: Relax USES=python 2023-05-28 07:44:42 +08:00
py-scoria
py-sdf
py-segregation
py-segyio
py-signac
py-SimpleSpectral
py-sklearn-pandas
py-skrebate
py-spaghetti science/py-spaghetti: Update to 1.7.3 2023-06-06 02:47:21 +08:00
py-spglib
py-tensorflow science/py-tensorflow: Enable the option JOBS_HALF in an attempt to fix build 2023-05-28 11:56:17 -07:00
py-thewalrus
py-tobler
py-trainstation
py-tweedledum science/py-tweedledum: Fix build on 14 by using gcc there 2023-06-18 10:56:46 -07:00
py-vedo math/vtk9: Update 9.2.2 → 9.2.6 2023-06-23 21:51:29 -07:00
py-veusz
py-xbout
pybrain
pynn science/pynn: Update to 0.11.0 2023-06-01 17:55:54 +08:00
q
qbox science/qbox: Update 1_75_1 → 1_76_0 2023-06-07 08:04:51 -07:00
qcl
qiskit-aer
qmcpack
quantum-espresso
quantum-espresso-pseudopotentials
quantum-jet
qwalk
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-FAdist
R-cran-fastICA
R-cran-kernlab
R-cran-ks
R-cran-snow
R-cran-som
R-cran-udunits2
rdkit science/rdkit: Update 2022_03_5 → 2023_03_2 2023-06-20 10:44:00 -07:00
rmf science/{,py-}rmf: Update 1.5.0 → 1.5.1 2023-06-18 11:23:36 -07:00
rubygem-ai4r
rubygem-cdo
rubygem-rgeo
rubygem-rgeo-geojson
rubygem-rgeo-proj4
rubygem-rgeo-shapefile
rubygem-ruby-netcdf
scidavis
sciplot
segyio science/segyio: Fix build on 14 2023-06-18 22:40:35 -07:00
serac science/hypre: Update 2.28.0 → 2.29.0 2023-06-25 01:26:02 -07:00
shelxle science/shelxle: Update 1.0.1529 → 1.0.1531 2023-06-23 01:27:07 -07:00
siconos
siesta
sigrok-cli
sigrok-firmware
sigrok-firmware-fx2lafw
sigrok-firmware-utils
silo
simbody
simgrid
simint
simlib
simple-dftd3
simsmith
sirius
smoldyn science/smoldyn: Update 2.69 → 2.71 2023-06-07 08:04:51 -07:00
sparta
spglib
spheral science/spheral: Update 2023.03.0 → 2023.03.1 2023-06-22 14:36:06 -07:00
step
svmlight
tblite science/tblite: Update 0.2.1 → 0.3.0 2023-06-06 21:45:25 -07:00
teem
tfel
tfel-edf
thermofun science/thermofun: Update 0.4.3 → 0.4.4 2023-06-09 20:59:11 -07:00
tinker science/tinker: Update 8.10.2 → 8.10.5 2023-06-06 21:45:24 -07:00
trilinos
ttk
tweedledum
udunits
ukrmol+
v_sim
vipster
vmd
voro++
votca science/votca: Update 2022 → 2022.1 2023-06-06 21:45:25 -07:00
wannier90
wwplot
wxmacmolplt
xcfun
xcrysden
xdrawchem
xtb
yoda
zotero
zx
Makefile science/py-dftbplus: New port: DFTB+: Package for performing fast atomistic simulations 2023-06-04 13:30:54 -07:00