mirror of
https://git.FreeBSD.org/ports.git
synced 2025-01-07 06:40:06 +00:00
b5e2bb3b11
GUI is "on" by default because that's what CMakeLists.txt suggests as default. Also improve helpers use.
312 lines
12 KiB
Plaintext
312 lines
12 KiB
Plaintext
bin/babel
|
|
bin/obabel
|
|
bin/obchiral
|
|
bin/obconformer
|
|
bin/obdistgen
|
|
bin/obenergy
|
|
bin/obfit
|
|
bin/obgen
|
|
bin/obgrep
|
|
%%GUI%%bin/obgui
|
|
bin/obminimize
|
|
bin/obprobe
|
|
bin/obprop
|
|
bin/obrms
|
|
bin/obrotamer
|
|
bin/obrotate
|
|
bin/obspectrophore
|
|
bin/obsym
|
|
bin/obtautomer
|
|
bin/obthermo
|
|
bin/roundtrip
|
|
include/inchi/inchi_api.h
|
|
include/openbabel-2.0/openbabel/alias.h
|
|
include/openbabel-2.0/openbabel/atom.h
|
|
include/openbabel-2.0/openbabel/atomclass.h
|
|
include/openbabel-2.0/openbabel/babelconfig.h
|
|
include/openbabel-2.0/openbabel/base.h
|
|
include/openbabel-2.0/openbabel/bitvec.h
|
|
include/openbabel-2.0/openbabel/bond.h
|
|
include/openbabel-2.0/openbabel/bondtyper.h
|
|
include/openbabel-2.0/openbabel/builder.h
|
|
include/openbabel-2.0/openbabel/canon.h
|
|
include/openbabel-2.0/openbabel/chains.h
|
|
include/openbabel-2.0/openbabel/chargemodel.h
|
|
include/openbabel-2.0/openbabel/chemdrawcdx.h
|
|
include/openbabel-2.0/openbabel/chiral.h
|
|
include/openbabel-2.0/openbabel/conformersearch.h
|
|
include/openbabel-2.0/openbabel/data.h
|
|
include/openbabel-2.0/openbabel/data_utilities.h
|
|
include/openbabel-2.0/openbabel/descriptor.h
|
|
include/openbabel-2.0/openbabel/distgeom.h
|
|
include/openbabel-2.0/openbabel/dlhandler.h
|
|
include/openbabel-2.0/openbabel/fingerprint.h
|
|
include/openbabel-2.0/openbabel/forcefield.h
|
|
include/openbabel-2.0/openbabel/format.h
|
|
include/openbabel-2.0/openbabel/generic.h
|
|
include/openbabel-2.0/openbabel/graphsym.h
|
|
include/openbabel-2.0/openbabel/grid.h
|
|
include/openbabel-2.0/openbabel/griddata.h
|
|
include/openbabel-2.0/openbabel/groupcontrib.h
|
|
include/openbabel-2.0/openbabel/inchiformat.h
|
|
include/openbabel-2.0/openbabel/internalcoord.h
|
|
include/openbabel-2.0/openbabel/isomorphism.h
|
|
include/openbabel-2.0/openbabel/json/customwriter.h
|
|
include/openbabel-2.0/openbabel/json/json-forwards.h
|
|
include/openbabel-2.0/openbabel/json/json.h
|
|
include/openbabel-2.0/openbabel/kinetics.h
|
|
include/openbabel-2.0/openbabel/lineend.h
|
|
include/openbabel-2.0/openbabel/locale.h
|
|
include/openbabel-2.0/openbabel/math/align.h
|
|
include/openbabel-2.0/openbabel/math/erf.h
|
|
include/openbabel-2.0/openbabel/math/matrix3x3.h
|
|
include/openbabel-2.0/openbabel/math/spacegroup.h
|
|
include/openbabel-2.0/openbabel/math/transform3d.h
|
|
include/openbabel-2.0/openbabel/math/vector3.h
|
|
include/openbabel-2.0/openbabel/matrix.h
|
|
include/openbabel-2.0/openbabel/mcdlutil.h
|
|
include/openbabel-2.0/openbabel/mol.h
|
|
include/openbabel-2.0/openbabel/molchrg.h
|
|
include/openbabel-2.0/openbabel/obconversion.h
|
|
include/openbabel-2.0/openbabel/oberror.h
|
|
include/openbabel-2.0/openbabel/obiter.h
|
|
include/openbabel-2.0/openbabel/obmolecformat.h
|
|
include/openbabel-2.0/openbabel/obutil.h
|
|
include/openbabel-2.0/openbabel/op.h
|
|
include/openbabel-2.0/openbabel/optransform.h
|
|
include/openbabel-2.0/openbabel/parsmart.h
|
|
include/openbabel-2.0/openbabel/patty.h
|
|
include/openbabel-2.0/openbabel/phmodel.h
|
|
include/openbabel-2.0/openbabel/plugin.h
|
|
include/openbabel-2.0/openbabel/pointgroup.h
|
|
include/openbabel-2.0/openbabel/query.h
|
|
include/openbabel-2.0/openbabel/rand.h
|
|
include/openbabel-2.0/openbabel/reaction.h
|
|
include/openbabel-2.0/openbabel/residue.h
|
|
include/openbabel-2.0/openbabel/ring.h
|
|
include/openbabel-2.0/openbabel/rotamer.h
|
|
include/openbabel-2.0/openbabel/rotor.h
|
|
include/openbabel-2.0/openbabel/shared_ptr.h
|
|
include/openbabel-2.0/openbabel/spectrophore.h
|
|
include/openbabel-2.0/openbabel/stereo/bindings.h
|
|
include/openbabel-2.0/openbabel/stereo/cistrans.h
|
|
include/openbabel-2.0/openbabel/stereo/squareplanar.h
|
|
include/openbabel-2.0/openbabel/stereo/stereo.h
|
|
include/openbabel-2.0/openbabel/stereo/tetrahedral.h
|
|
include/openbabel-2.0/openbabel/stereo/tetranonplanar.h
|
|
include/openbabel-2.0/openbabel/stereo/tetraplanar.h
|
|
include/openbabel-2.0/openbabel/tautomer.h
|
|
include/openbabel-2.0/openbabel/text.h
|
|
include/openbabel-2.0/openbabel/tokenst.h
|
|
include/openbabel-2.0/openbabel/typer.h
|
|
include/openbabel-2.0/openbabel/xml.h
|
|
lib/cmake/openbabel2/OpenBabel2Config.cmake
|
|
lib/cmake/openbabel2/OpenBabel2ConfigVersion.cmake
|
|
lib/cmake/openbabel2/OpenBabel2_EXPORTS-%%CMAKE_BUILD_TYPE%%.cmake
|
|
lib/cmake/openbabel2/OpenBabel2_EXPORTS.cmake
|
|
lib/libinchi.so
|
|
lib/libinchi.so.0
|
|
lib/libinchi.so.0.4.1
|
|
lib/libopenbabel.so
|
|
lib/libopenbabel.so.5
|
|
lib/libopenbabel.so.5.0.0
|
|
lib/openbabel/%%VERSION%%/APIInterface.so
|
|
lib/openbabel/%%VERSION%%/CSRformat.so
|
|
lib/openbabel/%%VERSION%%/MCDLformat.so
|
|
lib/openbabel/%%VERSION%%/MNAformat.so
|
|
lib/openbabel/%%VERSION%%/PQSformat.so
|
|
lib/openbabel/%%VERSION%%/abinitformat.so
|
|
lib/openbabel/%%VERSION%%/acesformat.so
|
|
lib/openbabel/%%VERSION%%/acrformat.so
|
|
lib/openbabel/%%VERSION%%/adfformat.so
|
|
lib/openbabel/%%VERSION%%/alchemyformat.so
|
|
lib/openbabel/%%VERSION%%/amberformat.so
|
|
lib/openbabel/%%VERSION%%/aoforceformat.so
|
|
lib/openbabel/%%VERSION%%/asciiformat.so
|
|
lib/openbabel/%%VERSION%%/balstformat.so
|
|
lib/openbabel/%%VERSION%%/bgfformat.so
|
|
lib/openbabel/%%VERSION%%/boxformat.so
|
|
lib/openbabel/%%VERSION%%/cacaoformat.so
|
|
lib/openbabel/%%VERSION%%/cacheformat.so
|
|
lib/openbabel/%%VERSION%%/carformat.so
|
|
lib/openbabel/%%VERSION%%/castepformat.so
|
|
lib/openbabel/%%VERSION%%/cccformat.so
|
|
lib/openbabel/%%VERSION%%/cdxmlformat.so
|
|
lib/openbabel/%%VERSION%%/chem3dformat.so
|
|
lib/openbabel/%%VERSION%%/chemdoodlejsonformat.so
|
|
lib/openbabel/%%VERSION%%/chemdrawcdx.so
|
|
lib/openbabel/%%VERSION%%/chemdrawct.so
|
|
lib/openbabel/%%VERSION%%/chemkinformat.so
|
|
lib/openbabel/%%VERSION%%/chemtoolformat.so
|
|
lib/openbabel/%%VERSION%%/cifformat.so
|
|
lib/openbabel/%%VERSION%%/cmlformat.so
|
|
lib/openbabel/%%VERSION%%/cmlreactformat.so
|
|
lib/openbabel/%%VERSION%%/confabreport.so
|
|
lib/openbabel/%%VERSION%%/copyformat.so
|
|
lib/openbabel/%%VERSION%%/crkformat.so
|
|
lib/openbabel/%%VERSION%%/crystal09format.so
|
|
lib/openbabel/%%VERSION%%/cssrformat.so
|
|
lib/openbabel/%%VERSION%%/daltonformat.so
|
|
lib/openbabel/%%VERSION%%/dlpolyformat.so
|
|
lib/openbabel/%%VERSION%%/dmolformat.so
|
|
lib/openbabel/%%VERSION%%/exyzformat.so
|
|
lib/openbabel/%%VERSION%%/fastaformat.so
|
|
lib/openbabel/%%VERSION%%/fastsearchformat.so
|
|
lib/openbabel/%%VERSION%%/fchkformat.so
|
|
lib/openbabel/%%VERSION%%/featformat.so
|
|
lib/openbabel/%%VERSION%%/fhformat.so
|
|
lib/openbabel/%%VERSION%%/fhiaimsformat.so
|
|
lib/openbabel/%%VERSION%%/fingerprintformat.so
|
|
lib/openbabel/%%VERSION%%/fpsformat.so
|
|
lib/openbabel/%%VERSION%%/freefracformat.so
|
|
lib/openbabel/%%VERSION%%/gamessformat.so
|
|
lib/openbabel/%%VERSION%%/gamessukformat.so
|
|
lib/openbabel/%%VERSION%%/gausscubeformat.so
|
|
lib/openbabel/%%VERSION%%/gaussformat.so
|
|
lib/openbabel/%%VERSION%%/gausszmatformat.so
|
|
lib/openbabel/%%VERSION%%/ghemicalformat.so
|
|
lib/openbabel/%%VERSION%%/groformat.so
|
|
lib/openbabel/%%VERSION%%/gromos96format.so
|
|
lib/openbabel/%%VERSION%%/gulpformat.so
|
|
lib/openbabel/%%VERSION%%/hinformat.so
|
|
lib/openbabel/%%VERSION%%/inchiformat.so
|
|
lib/openbabel/%%VERSION%%/jaguarformat.so
|
|
lib/openbabel/%%VERSION%%/lmpdatformat.so
|
|
lib/openbabel/%%VERSION%%/lpmdformat.so
|
|
lib/openbabel/%%VERSION%%/mdffformat.so
|
|
lib/openbabel/%%VERSION%%/mdlformat.so
|
|
lib/openbabel/%%VERSION%%/mmcifformat.so
|
|
lib/openbabel/%%VERSION%%/mmodformat.so
|
|
lib/openbabel/%%VERSION%%/mol2format.so
|
|
lib/openbabel/%%VERSION%%/moldenformat.so
|
|
lib/openbabel/%%VERSION%%/molproformat.so
|
|
lib/openbabel/%%VERSION%%/molreport.so
|
|
lib/openbabel/%%VERSION%%/mopacformat.so
|
|
lib/openbabel/%%VERSION%%/mpdformat.so
|
|
lib/openbabel/%%VERSION%%/mpqcformat.so
|
|
lib/openbabel/%%VERSION%%/msiformat.so
|
|
lib/openbabel/%%VERSION%%/msmsformat.so
|
|
lib/openbabel/%%VERSION%%/nulformat.so
|
|
lib/openbabel/%%VERSION%%/nwchemformat.so
|
|
lib/openbabel/%%VERSION%%/opendxformat.so
|
|
lib/openbabel/%%VERSION%%/orcaformat.so
|
|
lib/openbabel/%%VERSION%%/outformat.so
|
|
lib/openbabel/%%VERSION%%/painterformat.so
|
|
lib/openbabel/%%VERSION%%/pcmodelformat.so
|
|
lib/openbabel/%%VERSION%%/pdbformat.so
|
|
lib/openbabel/%%VERSION%%/pdbqtformat.so
|
|
lib/openbabel/%%VERSION%%/plugin_charges.so
|
|
lib/openbabel/%%VERSION%%/plugin_descriptors.so
|
|
lib/openbabel/%%VERSION%%/plugin_fingerprints.so
|
|
lib/openbabel/%%VERSION%%/plugin_forcefields.so
|
|
lib/openbabel/%%VERSION%%/plugin_ops.so
|
|
%%CAIRO%%lib/openbabel/%%VERSION%%/png2format.so
|
|
lib/openbabel/%%VERSION%%/pngformat.so
|
|
lib/openbabel/%%VERSION%%/pointcloudformat.so
|
|
lib/openbabel/%%VERSION%%/posformat.so
|
|
lib/openbabel/%%VERSION%%/povrayformat.so
|
|
lib/openbabel/%%VERSION%%/pqrformat.so
|
|
lib/openbabel/%%VERSION%%/pubchem.so
|
|
lib/openbabel/%%VERSION%%/pubchemjsonformat.so
|
|
lib/openbabel/%%VERSION%%/pwscfformat.so
|
|
lib/openbabel/%%VERSION%%/qchemformat.so
|
|
lib/openbabel/%%VERSION%%/reportformat.so
|
|
lib/openbabel/%%VERSION%%/rsmiformat.so
|
|
lib/openbabel/%%VERSION%%/rxnformat.so
|
|
lib/openbabel/%%VERSION%%/shelxformat.so
|
|
lib/openbabel/%%VERSION%%/siestaformat.so
|
|
lib/openbabel/%%VERSION%%/smilesformat.so
|
|
lib/openbabel/%%VERSION%%/smileyformat.so
|
|
lib/openbabel/%%VERSION%%/stlformat.so
|
|
lib/openbabel/%%VERSION%%/svgformat.so
|
|
lib/openbabel/%%VERSION%%/textformat.so
|
|
lib/openbabel/%%VERSION%%/thermoformat.so
|
|
lib/openbabel/%%VERSION%%/tinkerformat.so
|
|
lib/openbabel/%%VERSION%%/titleformat.so
|
|
lib/openbabel/%%VERSION%%/turbomoleformat.so
|
|
lib/openbabel/%%VERSION%%/unichemformat.so
|
|
lib/openbabel/%%VERSION%%/vaspformat.so
|
|
lib/openbabel/%%VERSION%%/viewmolformat.so
|
|
lib/openbabel/%%VERSION%%/xedformat.so
|
|
lib/openbabel/%%VERSION%%/xmlformat.so
|
|
lib/openbabel/%%VERSION%%/xsfformat.so
|
|
lib/openbabel/%%VERSION%%/xyzformat.so
|
|
lib/openbabel/%%VERSION%%/yasaraformat.so
|
|
lib/openbabel/%%VERSION%%/zindoformat.so
|
|
%%PYTHON%%%%PYTHON_SITELIBDIR%%/_openbabel.so
|
|
%%PYTHON%%%%PYTHON_SITELIBDIR%%/openbabel.py
|
|
%%PYTHON%%%%PYTHON_SITELIBDIR%%/pybel.py
|
|
libdata/pkgconfig/openbabel-2.0.pc
|
|
man/man1/babel.1.gz
|
|
man/man1/obabel.1.gz
|
|
man/man1/obchiral.1.gz
|
|
man/man1/obconformer.1.gz
|
|
man/man1/obenergy.1.gz
|
|
man/man1/obfit.1.gz
|
|
man/man1/obgen.1.gz
|
|
man/man1/obgrep.1.gz
|
|
man/man1/obgui.1.gz
|
|
man/man1/obminimize.1.gz
|
|
man/man1/obprobe.1.gz
|
|
man/man1/obprop.1.gz
|
|
man/man1/obrotamer.1.gz
|
|
man/man1/obrotate.1.gz
|
|
man/man1/obspectrophore.1.gz
|
|
man/man1/roundtrip.1.gz
|
|
%%DATADIR%%/%%VERSION%%/MACCS.txt
|
|
%%DATADIR%%/%%VERSION%%/SMARTS_InteLigand.txt
|
|
%%DATADIR%%/%%VERSION%%/UFF.prm
|
|
%%DATADIR%%/%%VERSION%%/aromatic.txt
|
|
%%DATADIR%%/%%VERSION%%/atomization-energies.txt
|
|
%%DATADIR%%/%%VERSION%%/atomtyp.txt
|
|
%%DATADIR%%/%%VERSION%%/babel_povray3.inc
|
|
%%DATADIR%%/%%VERSION%%/bondtyp.txt
|
|
%%DATADIR%%/%%VERSION%%/eem.txt
|
|
%%DATADIR%%/%%VERSION%%/eem2015ba.txt
|
|
%%DATADIR%%/%%VERSION%%/eem2015bm.txt
|
|
%%DATADIR%%/%%VERSION%%/eem2015bn.txt
|
|
%%DATADIR%%/%%VERSION%%/eem2015ha.txt
|
|
%%DATADIR%%/%%VERSION%%/eem2015hm.txt
|
|
%%DATADIR%%/%%VERSION%%/eem2015hn.txt
|
|
%%DATADIR%%/%%VERSION%%/element.txt
|
|
%%DATADIR%%/%%VERSION%%/eqeqIonizations.txt
|
|
%%DATADIR%%/%%VERSION%%/fragments.txt
|
|
%%DATADIR%%/%%VERSION%%/gaff.dat
|
|
%%DATADIR%%/%%VERSION%%/gaff.prm
|
|
%%DATADIR%%/%%VERSION%%/ghemical.prm
|
|
%%DATADIR%%/%%VERSION%%/isotope-small.txt
|
|
%%DATADIR%%/%%VERSION%%/isotope.txt
|
|
%%DATADIR%%/%%VERSION%%/logp.txt
|
|
%%DATADIR%%/%%VERSION%%/mpC.txt
|
|
%%DATADIR%%/%%VERSION%%/mmff94.ff
|
|
%%DATADIR%%/%%VERSION%%/mmff94s.ff
|
|
%%DATADIR%%/%%VERSION%%/mmffang.par
|
|
%%DATADIR%%/%%VERSION%%/mmffbndk.par
|
|
%%DATADIR%%/%%VERSION%%/mmffbond.par
|
|
%%DATADIR%%/%%VERSION%%/mmffchg.par
|
|
%%DATADIR%%/%%VERSION%%/mmffdef.par
|
|
%%DATADIR%%/%%VERSION%%/mmffdfsb.par
|
|
%%DATADIR%%/%%VERSION%%/mmffoop.par
|
|
%%DATADIR%%/%%VERSION%%/mmffpbci.par
|
|
%%DATADIR%%/%%VERSION%%/mmffprop.par
|
|
%%DATADIR%%/%%VERSION%%/mmffs_oop.par
|
|
%%DATADIR%%/%%VERSION%%/mmffs_tor.par
|
|
%%DATADIR%%/%%VERSION%%/mmffstbn.par
|
|
%%DATADIR%%/%%VERSION%%/mmfftor.par
|
|
%%DATADIR%%/%%VERSION%%/mmffvdw.par
|
|
%%DATADIR%%/%%VERSION%%/mr.txt
|
|
%%DATADIR%%/%%VERSION%%/patterns.txt
|
|
%%DATADIR%%/%%VERSION%%/phmodel.txt
|
|
%%DATADIR%%/%%VERSION%%/plugindefines.txt
|
|
%%DATADIR%%/%%VERSION%%/psa.txt
|
|
%%DATADIR%%/%%VERSION%%/qeq.txt
|
|
%%DATADIR%%/%%VERSION%%/resdata.txt
|
|
%%DATADIR%%/%%VERSION%%/ringtyp.txt
|
|
%%DATADIR%%/%%VERSION%%/space-groups.txt
|
|
%%DATADIR%%/%%VERSION%%/splash.png
|
|
%%DATADIR%%/%%VERSION%%/superatom.txt
|
|
%%DATADIR%%/%%VERSION%%/svgformat.script
|
|
%%DATADIR%%/%%VERSION%%/templates.sdf
|
|
%%DATADIR%%/%%VERSION%%/torlib.txt
|
|
%%DATADIR%%/%%VERSION%%/types.txt
|