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mirror of https://git.FreeBSD.org/ports.git synced 2025-01-15 07:56:36 +00:00
freebsd-ports/science
Yuri Victorovich 2de9d6e869 science/rdkit: Broken on i386
Reported by:	fallout
2022-01-22 01:06:37 -08:00
..
2d-rewriter
abinit
afni
agrum
aircraft-datcom
ALPSCore
antioch
apbs
ascent
atompaw
avogadro2
avogadrolibs
axom
bagel
bddsolve
berkeleygw
bodr
buddy
cantera
cdcl
cdf *: Clean up some things 2022-01-17 14:20:25 +01:00
cdk
cdo
cgnslib
cgribex
checkmol
chemical-mime-data
chemicalfun science/chemicalfun: New port: C++ library for working with chemical reactions and formulas 2022-01-18 10:42:45 -08:00
chemps2
chemtool
chemtool-devel
chimes-calculator science/chimes-calculator: New port: Chebyshev Interaction Model for Efficient Simulation 2022-01-18 23:05:13 -08:00
chrono
clhep
clipper
code_saturne
colt
conduit
coordgenlibs
cp2k
cp2k-data
crf++
csvtk
dakota
dalton
dcl
devisor
dftbplus science/dftbplus: Fix tests 2022-01-16 15:30:33 -08:00
dftd4 */*: In 7 ports remove GNU-10.3.0 from install paths 2022-01-18 12:12:05 -08:00
dkh
dlib-cpp
drawxtl
dvc
dynare
eccodes
elk
elmerfem
epte
erd
ergo
erkale
erkale-pseudopotentials
fastcap
fasthenry
fastjet
fisicalab
fleur
frontistr
fsom
fvcom
fvcom-mpi
gabedit
gamess-us
gchemutils
gdma
getdp
ghemical
ghmm
gnudatalanguage
gpaw-setups
gramps
grib_api
gromacs
gsmc
gtamsanalyzer
h5utils
h5z-zfp
harminv
hdf
hdf5
hdf5-18
healpix
helfem
hepmc3
highfive
hypre
iboview
InsightToolkit
isaac-cfd
jdftx
jmol science/jmol: Update 14.32.13 -> 14.32.14 2022-01-20 15:31:43 -08:00
jstrack
kalzium
kim-api
kst2
lammps
lamprop
latte
libaec
libccp4
libcint
libctl
libecpint
libefp
libgeodecomp
libghemical
libgridxc
libint
libint2
libkml
liblinear
libmbd science/libmbd: New port: Many-body dispersion library 2022-01-16 21:15:11 -08:00
libmsym
libnegf science/libnegf: Add options; Correct license 2022-01-17 14:41:21 -08:00
liboglappth
libquantum
libssm
libsvm
libsvm-python
libvdwxc
libxc
liggghts
linux-zotero
luscus
madness
maeparser
massxpert
mbdyn
mcstas
mcstas-comps
mctc-lib */*: In 7 ports remove GNU-10.3.0 from install paths 2022-01-18 12:12:05 -08:00
mcxtrace
mcxtrace-comps
mdynamix
medit
metaphysicl
minc2
mmdb2
mmtf-cpp
mol2ps
molgif
molscript
molsketch
mpb
mpqc
msms
mstore */*: In 7 ports remove GNU-10.3.0 from install paths 2022-01-18 12:12:05 -08:00
multicharge */*: In 7 ports remove GNU-10.3.0 from install paths 2022-01-18 12:12:05 -08:00
multiwfn
namd
nest
netcdf
netcdf-cxx
netcdf-fortran
nifticlib
nwchem
nwchem-data
octopus
openbabel
openems
openkim
openkim-models
openmc
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-Coordinates-Converter
p5-Geo-Coordinates-Converter-iArea
p5-Geo-WebService-Elevation-USGS
p5-Mcstas-Tools
p5-PerlMol
p5-Physics-Unit
packmol
pagmo2
paje
pcmsolver
PETSc
phonopy
plumed
pnetcdf
pulseview
py-abipy
py-access
py-asdf
py-ase
py-avogadrolibs
py-cdo
py-chainer
py-chainer-chemistry
py-chempy
py-cirq-aqt
py-cirq-core
py-cirq-google
py-cirq-ionq
py-cirq-pasqal
py-coards
py-DendroPy
py-dipy
py-dlib
py-eccodes
py-esda
py-geolinks
py-geomet
py-geometer
py-geometric
py-gpaw
py-GPy
py-GPyOpt
py-gsd science/py-gsd: Update 2.5.0 -> 2.5.1 2022-01-21 02:00:30 -08:00
py-h5json
py-h5py
py-hiphive
py-hoomd-blue science/py-hoomd-blue: Backport patch supporting latest cereal. 2022-01-21 17:37:21 -08:00
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
py-netcdf-flattener
py-nibabel
py-nilearn
py-obspy
py-oddt
py-OpenFermion
py-OpenMC
py-openpiv
py-paida
py-paramz
py-phono3py
py-phonopy
py-PubChemPy
py-pupynere
py-pyaixi
py-pyberny
py-pycsw
py-pydicom
py-PyFR
py-pygeodesy
py-pygeometa
py-pygmo2
py-pyked
py-pymatgen
py-pymol
py-PyNE
py-pyosf
py-pysal
py-pyscf
py-pyteomics
py-qcelemental
py-qcengine
py-qspin
py-quantities
py-rmf
py-rmsd
py-ruffus
py-scikit-fuzzy
py-scikit-learn
py-scikit-optimize
py-scikit-sparse
py-scimath
py-scipy
py-scoria
py-segregation
py-segyio
py-SimpleSpectral
py-skrebate
py-spaghetti
py-spglib
py-tensorflow
py-tobler
py-veusz
pybrain
pynn
qbox
qcl
qiskit-aer
qmcpack *: Clean up some things 2022-01-17 14:20:25 +01:00
quantum-espresso
quantum-espresso-pseudopotentials
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-FAdist
R-cran-fastICA
R-cran-kernlab
R-cran-snow
R-cran-som
R-cran-udunits2
rdkit science/rdkit: Broken on i386 2022-01-22 01:06:37 -08:00
rmf
rubygem-ai4r
rubygem-cdo
rubygem-rgeo
rubygem-rgeo-geojson
rubygem-rgeo-proj4
rubygem-rgeo-shapefile
rubygem-ruby-dcl
rubygem-ruby-netcdf
scidavis
segyio
shelxle science/shelxle: Update 1.0.1354 -> 1.0.1356 2022-01-20 15:31:42 -08:00
siconos
siesta
sigrok-cli
sigrok-firmware
sigrok-firmware-fx2lafw
sigrok-firmware-utils
silo
simbody
simgrid
simint
simlib
simple-dftd3 */*: In 7 ports remove GNU-10.3.0 from install paths 2022-01-18 12:12:05 -08:00
simsmith
smoldyn
sparta
spglib
step
svmlight
szip
tblite */*: In 7 ports remove GNU-10.3.0 from install paths 2022-01-18 12:12:05 -08:00
teem
tfel
tfel-edf
thermofun science/thermofun: Update 0.3.8 -> 0.3.9 2022-01-18 10:42:45 -08:00
tinker
udunits
v_sim
vipster
vmd
voro++
votca
wannier90
wwplot
wxmacmolplt
xcfun
xcrysden
xdrawchem
xtb
yoda
Makefile science/py-hoomd-blue: New port: Molecular dynamics and Monte Carlo soft matter simulation 2022-01-21 02:00:30 -08:00