Po-Chuan Hsieh 3854f7215b science/py-MDAnalysisTests: Convert to USE_PYTHON=pytest ... With hat: python		2022-12-30 17:06:30 +08:00
..
2d-rewriter
abinit
afni
agrum
aircraft-datcom
ALPSCore
antioch
apbs
arbor	science/{,py-}arbor: Update 0.8 -> 0.8.1	2022-12-24 03:06:21 -08:00
ascent
atompaw
avogadro2
avogadrolibs
axom
bagel
bddsolve
berkeleygw
bodr
bout++	science/bout++: Remove installed broken link; Add pkg-message	2022-12-24 17:22:58 -08:00
bout++-merging-filaments	science/bout++-merging-filaments: New port: Simulation of reconnection during merging of current filaments	2022-12-24 17:22:59 -08:00
buddy
cantera
cardioid
cdcl
cdf
cdk
cdo
cgnslib
cgribex
checkmol
chemical-mime-data
chemicalfun	science/chemicalfun: Update 0.1.3 -> 0.1.7	2022-12-27 23:56:48 -08:00
chemps2
chemtool
chemtool-devel
chimes-calculator
ChipmunkPhysics
chrono
cif-tools
clhep	science/clhep: Update version 2.4.1.0=>2.4.6.3	2022-12-27 13:26:36 -06:00
clipper
code_saturne
colt
conduit
coordgenlibs
cp2k
cp2k-data
crf++
csvtk
dakota
dalton
dcl
dd_package
devisor
dftbplus
dftd3
dftd4
dimod	science/dimod: Update 0.12.2 -> 0.12.3	2022-12-25 22:13:15 -08:00
dirac
dkh
dlib-cpp
drawxtl
dssp
dvc
dwave-preprocessing
dynare	science/dynare: Update 5.2 -> 5.3	2022-12-22 00:43:31 -08:00
eccodes
elk
elmerfem
epte
erd
ergo
erkale
erkale-pseudopotentials
fastcap
fasthenry
fastjet
feff10
fisicalab
fleur
frontistr
fsom
fvcom
fvcom-mpi
gabedit	science/gabedit: enable on libomp-less architectures and disable OPENMP	2022-12-25 20:44:15 +00:00
gamess-us
gbtolib
gchemutils
gdma
geant4	science/geant4: adding Geant4, a TK for the simulation of the passage of particles through matter	2022-12-26 16:04:31 +01:00
gemmi	science/{,py-}gemmi: Update 0.5.7 -> 0.5.8	2022-12-25 03:00:41 -08:00
getdp
ghemical
ghmm
gnudatalanguage
gpaw-setups
gramps
grib_api
gromacs	science/gromacs: Update 2022.3 -> 2022.4	2022-12-25 23:19:03 -08:00
gsmc
gtamsanalyzer
h5utils
h5z-zfp
harminv
hdf
hdf5
hdf5-18
hdf5-110
healpix	astro/cfitsio: Update to 4.2.0	2022-12-30 17:04:05 +08:00
helfem
hepmc3
highfive
hypre
iboview
InsightToolkit
InsightToolkit501
InsightToolkit521
isaac-cfd
jdftx
jmol
jstrack	science/jstrack: Fix MASTER_SITES	2022-12-23 21:01:44 -06:00
kalzium
kim-api
kplib
kst2	astro/cfitsio: Update to 4.2.0	2022-12-30 17:04:05 +08:00
lammps
lamprop
latte
libaec
libccp4
libcifpp
libcint
libctl
libecpint
libefp
libgeodecomp
libgetar
libghemical
libgridxc
libint
libint2
libint2-psi4
libkml
liblinear
libmbd
libmsym
libnegf
liboglappth
libquantum
libssm
libsvm
libsvm-python
libtensorflow1
libvdwxc
libxc
liggghts
linux-zotero
luscus
m-aneos
madness
maeparser
massxpert
mbdyn
mcstas
mcstas-comps
mctc-lib
mcxtrace
mcxtrace-comps
mdynamix
medit
meep
mercantile
metaphysicl
minc2
mmdb2
mmtf-cpp
mol2ps
molgif
molscript
molsketch
mopac
mp2d
mpb
mpqc
mrchem
mrcpp
msms
mstore
multicharge
multiwfn
namd
nest
netcdf
netcdf-cxx
netcdf-fortran
nifticlib
nlcglib
nwchem
nwchem-data
ocean
octopus
openbabel
openems
openkim-models
openmc
openmodelica
openmolcas
openmx
opensim-core
opensph
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	science/p5-Geo-Coordinates-Transform: Add p5-Geo-Coordinates-Transform 0.10	2022-12-30 17:04:00 +08:00
p5-Geo-WebService-Elevation-USGS
p5-Mcstas-Tools
p5-PerlMol
p5-Physics-Unit
packmol
pagmo2
paje
paraview
pastix
pcmsolver
PETSc	science/PETSc: Update 3.16.3 -> 3.18.2	2022-12-22 00:43:32 -08:00
phonopy
plumed
pnetcdf
polytope
precice
psi4
pulseview
py-abipy
py-access
py-arbor	science/{,py-}arbor: Update 0.8 -> 0.8.1	2022-12-24 03:06:21 -08:00
py-arch	science/py-arch: New port: Autoregressive Conditional Heteroskedasticity (ARCH) models	2022-12-26 13:00:29 -08:00
py-asap3
py-asdf
py-asdf-standard
py-asdf-transform-schemas
py-ase
py-atomium
py-avogadrolibs
py-boutdata	science/py-boutdata: New port: Python package for collecting BOUT++ data	2022-12-24 03:31:56 -08:00
py-boututils	science/py-boututils: New port: Python package containing BOUT++ utils	2022-12-24 03:06:22 -08:00
py-cdo	science/py-cdo: Update to 1.5.7	2022-12-30 17:05:05 +08:00
py-chainer
py-chainer-chemistry
py-chempy
py-cirq-aqt	science/py-cirq-*: Update 1.0.0 -> 1.1.0	2022-12-25 23:19:04 -08:00
py-cirq-core	science/py-cirq-*: Update 1.0.0 -> 1.1.0	2022-12-25 23:19:04 -08:00
py-cirq-google	science/py-cirq-*: Update 1.0.0 -> 1.1.0	2022-12-25 23:19:04 -08:00
py-cirq-ionq	science/py-cirq-*: Update 1.0.0 -> 1.1.0	2022-12-25 23:19:04 -08:00
py-cirq-pasqal	science/py-cirq-*: Update 1.0.0 -> 1.1.0	2022-12-25 23:19:04 -08:00
py-cirq-rigetti	science/py-cirq-*: Update 1.0.0 -> 1.1.0	2022-12-25 23:19:04 -08:00
py-coards
py-DendroPy
py-dimod	science/py-dimod: Update 0.12.2 -> 0.12.3	2022-12-25 01:57:46 -08:00
py-dipy
py-dlib
py-dwave-cloud-client	science/py-dwave-cloud-client: Update 0.10.2 -> 0.10.4	2022-12-25 01:57:41 -08:00
py-dwave-greedy	science/py-dwave-greedy: Update 0.2.5 -> 0.3.0	2022-12-25 01:57:40 -08:00
py-dwave-hybrid	science/py-dwave-hybrid: Update 0.6.9 -> 0.6.10	2022-12-25 01:57:44 -08:00
py-dwave-inspector	science/py-dwave-inspector: Update 0.3.0 -> 0.4.0	2022-12-25 01:57:45 -08:00
py-dwave-neal	science/py-dwave-neal: Update 0.6.0.dev0 -> 0.6.0	2022-12-25 01:57:42 -08:00
py-dwave-networkx	science/py-dwave-networkx: Update 0.8.12 -> 0.8.13	2022-12-24 17:22:58 -08:00
py-dwave-ocean-sdk	science/py-dwave-ocean-sdk: Update 5.5.0 -> 6.2.0	2022-12-25 01:57:47 -08:00
py-dwave-preprocessing	science/py-dwave-preprocessing: Update 0.5.2 -> 0.5.4	2022-12-25 01:57:43 -08:00
py-dwave-samplers	science/py-dwave-samplers: Update 1.0.0.dev2 -> 1.0.0	2022-12-25 01:57:39 -08:00
py-dwave-system	science/py-dwave-system: Update 1.16.0 -> 1.18.0	2022-12-25 01:57:43 -08:00
py-dwave-tabu	science/py-dwave-tabu: Update 0.4.5 -> 0.5.0	2022-12-25 01:57:41 -08:00
py-dwavebinarycsp
py-earthpy
py-eccodes
py-esda
py-fresnel
py-gemmi	science/{,py-}gemmi: Update 0.5.7 -> 0.5.8	2022-12-25 03:00:41 -08:00
py-geolinks
py-geomet	science/py-geomet: Update to 1.0.0	2022-12-30 17:05:05 +08:00
py-geometer
py-geometric
py-gpaw
py-GPy
py-GPyOpt
py-gsd
py-h5json
py-h5py
py-hiphive
py-hoomd-blue
py-inequality
py-jupyter_jsmol
py-kim-query
py-kimpy
py-kinematics
py-kliff
py-kpLib
py-liac-arff
py-libgetar
py-libpysal	science/py-libpysal: Update to 4.7.0	2022-12-30 17:05:05 +08:00
py-lifelines
py-MDAnalysis
py-MDAnalysisTests	science/py-MDAnalysisTests: Convert to USE_PYTHON=pytest	2022-12-30 17:06:30 +08:00
py-mdp
py-meshio
py-mmcif
py-mmtf-python
py-molmod
py-moltemplate
py-mrchem
py-netCDF4
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
py-PyFR
py-pygeodesy
py-pygeometa
py-pygmo2
py-pyked
py-pymatgen
py-pymbd
py-pymol
py-PyNE
py-pyosf
py-pyprecice
py-pyqubo	science/py-pyqubo: Update 1.3.0 -> 1.4.0	2022-12-25 01:57:45 -08:00
py-pysal
py-pyscf
py-pyteomics	science/py-pyteomics: Update to 4.5.6	2022-12-30 17:05:06 +08:00
py-qcelemental
py-qcengine
py-qiskit
py-qiskit-aer
py-qiskit-experiments
py-qiskit-finance
py-qiskit-ibm-experiment
py-qiskit-ibm-provider
py-qiskit-ibmq-provider
py-qiskit-nature
py-qiskit-optimization
py-qiskit-terra
py-qspin
py-quantities
py-rmf	science/{,py-}rmf: Update 1.4 -> 1.4.1	2022-12-25 22:13:14 -08:00
py-rmsd
py-ruffus
py-scikit-fuzzy
py-scikit-learn
py-scikit-optimize
py-scikit-sparse
py-scimath
py-scipy
py-scoria
py-sdf
py-segregation
py-segyio
py-SimpleSpectral
py-sklearn-pandas
py-skrebate
py-spaghetti	science/py-spaghetti: Update to 1.6.10	2022-12-30 17:05:06 +08:00
py-spglib
py-tensorflow
py-thewalrus
py-tobler
py-trainstation
py-tweedledum
py-veusz
py-xbout	science/py-xbout: New port: Collect data from BOUT++ runs in python using xarray	2022-12-24 17:22:57 -08:00
pybrain
pynn
q
qbox
qcl
qiskit-aer
qmcpack
quantum-espresso
quantum-espresso-pseudopotentials
quantum-jet
qwalk
R-cran-bayesm	science/R-cran-bayesm: Update to 3.1.5	2022-12-22 22:09:10 +08:00
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
rmf	science/{,py-}rmf: Update 1.4 -> 1.4.1	2022-12-25 22:13:14 -08:00
rubygem-ai4r
rubygem-cdo
rubygem-rgeo
rubygem-rgeo-geojson
rubygem-rgeo-proj4
rubygem-rgeo-shapefile
rubygem-ruby-dcl
rubygem-ruby-netcdf
scidavis
sciplot
segyio
serac
shelxle
siconos
siesta
sigrok-cli
sigrok-firmware
sigrok-firmware-fx2lafw
sigrok-firmware-utils
silo
simbody
simgrid
simint
simlib
simple-dftd3
simsmith
sirius
smoldyn
sparta
spglib
spheral
step
svmlight
tblite
teem
tfel
tfel-edf
thermofun
tinker
trilinos
ttk
tweedledum
udunits
ukrmol+
v_sim
vipster
vmd
voro++
votca
wannier90
wwplot
wxmacmolplt
xcfun
xcrysden
xdrawchem
xtb
yoda
zotero
zx
Makefile	science/p5-Geo-Coordinates-Transform: Add p5-Geo-Coordinates-Transform 0.10	2022-12-30 17:04:00 +08:00