openbabel-2.4.1-4-x86_64.pkg.tar.xz


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Description

openbabel - A library designed to interconvert between many file formats used in molecular modeling and computational chemistry

Distribution: Arch Linux
Repository: Arch Linux Extra x86_64
Package name: openbabel
Package version: 2.4.1
Package release: 4
Package architecture: x86_64
Package type: xz
Installed size: 14.36 MB
Download size: 3.24 MB
Official Mirror: ftp5.gwdg.de
A library designed to interconvert between many file formats used in molecular modeling and computational chemistry. Packager: Jelle van der Waa <jelle@archlinux.org>. License: GPL

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Requires

    Download

    Source package: openbabel

    Install Howto

    1. Enable the extra repository on /etc/pacman.conf:
      [extra]
      Include = /etc/pacman.d/mirrorlist
      
    2. Install openbabel xz package:
      # pacman -Sy openbabel

    Files

    • /usr/
    • /usr/bin/babel
    • /usr/bin/obabel
    • /usr/bin/obchiral
    • /usr/bin/obconformer
    • /usr/bin/obdistgen
    • /usr/bin/obenergy
    • /usr/bin/obfit
    • /usr/bin/obgen
    • /usr/bin/obgrep
    • /usr/bin/obgui
    • /usr/bin/obminimize
    • /usr/bin/obprobe
    • /usr/bin/obprop
    • /usr/bin/obrms
    • /usr/bin/obrotamer
    • /usr/bin/obrotate
    • /usr/bin/obspectrophore
    • /usr/bin/obsym
    • /usr/bin/obtautomer
    • /usr/bin/obthermo
    • /usr/bin/roundtrip
    • /usr/include/
    • /usr/include/inchi/inchi_api.h
    • /usr/include/openbabel-2.0/
    • /usr/include/openbabel-2.0/openbabel/alias.h
    • /usr/include/openbabel-2.0/openbabel/atom.h
    • /usr/include/openbabel-2.0/openbabel/atomclass.h
    • /usr/include/openbabel-2.0/openbabel/babelconfig.h
    • /usr/include/openbabel-2.0/openbabel/base.h
    • /usr/include/openbabel-2.0/openbabel/bitvec.h
    • /usr/include/openbabel-2.0/openbabel/bond.h
    • /usr/include/openbabel-2.0/openbabel/bondtyper.h
    • /usr/include/openbabel-2.0/openbabel/builder.h
    • /usr/include/openbabel-2.0/openbabel/canon.h
    • /usr/include/openbabel-2.0/openbabel/chains.h
    • /usr/include/openbabel-2.0/openbabel/chargemodel.h
    • /usr/include/openbabel-2.0/openbabel/chemdrawcdx.h
    • /usr/include/openbabel-2.0/openbabel/chiral.h
    • /usr/include/openbabel-2.0/openbabel/conformersearch.h
    • /usr/include/openbabel-2.0/openbabel/data.h
    • /usr/include/openbabel-2.0/openbabel/data_utilities.h
    • /usr/include/openbabel-2.0/openbabel/descriptor.h
    • /usr/include/openbabel-2.0/openbabel/distgeom.h
    • /usr/include/openbabel-2.0/openbabel/dlhandler.h
    • /usr/include/openbabel-2.0/openbabel/fingerprint.h
    • /usr/include/openbabel-2.0/openbabel/forcefield.h
    • /usr/include/openbabel-2.0/openbabel/format.h
    • /usr/include/openbabel-2.0/openbabel/generic.h
    • /usr/include/openbabel-2.0/openbabel/graphsym.h
    • /usr/include/openbabel-2.0/openbabel/grid.h
    • /usr/include/openbabel-2.0/openbabel/griddata.h
    • /usr/include/openbabel-2.0/openbabel/groupcontrib.h
    • /usr/include/openbabel-2.0/openbabel/inchiformat.h
    • /usr/include/openbabel-2.0/openbabel/internalcoord.h
    • /usr/include/openbabel-2.0/openbabel/isomorphism.h
    • /usr/include/openbabel-2.0/openbabel/kinetics.h
    • /usr/include/openbabel-2.0/openbabel/lineend.h
    • /usr/include/openbabel-2.0/openbabel/locale.h
    • /usr/include/openbabel-2.0/openbabel/matrix.h
    • /usr/include/openbabel-2.0/openbabel/mcdlutil.h
    • /usr/include/openbabel-2.0/openbabel/mol.h
    • /usr/include/openbabel-2.0/openbabel/molchrg.h
    • /usr/include/openbabel-2.0/openbabel/obconversion.h
    • /usr/include/openbabel-2.0/openbabel/oberror.h
    • /usr/include/openbabel-2.0/openbabel/obiter.h
    • /usr/include/openbabel-2.0/openbabel/obmolecformat.h
    • /usr/include/openbabel-2.0/openbabel/obutil.h
    • /usr/include/openbabel-2.0/openbabel/op.h
    • /usr/include/openbabel-2.0/openbabel/optransform.h
    • /usr/include/openbabel-2.0/openbabel/parsmart.h
    • /usr/include/openbabel-2.0/openbabel/patty.h
    • /usr/include/openbabel-2.0/openbabel/phmodel.h
    • /usr/include/openbabel-2.0/openbabel/plugin.h
    • /usr/include/openbabel-2.0/openbabel/pointgroup.h
    • /usr/include/openbabel-2.0/openbabel/query.h
    • /usr/include/openbabel-2.0/openbabel/rand.h
    • /usr/include/openbabel-2.0/openbabel/reaction.h
    • /usr/include/openbabel-2.0/openbabel/residue.h
    • /usr/include/openbabel-2.0/openbabel/ring.h
    • /usr/include/openbabel-2.0/openbabel/rotamer.h
    • /usr/include/openbabel-2.0/openbabel/rotor.h
    • /usr/include/openbabel-2.0/openbabel/shared_ptr.h
    • /usr/include/openbabel-2.0/openbabel/spectrophore.h
    • /usr/include/openbabel-2.0/openbabel/tautomer.h
    • /usr/include/openbabel-2.0/openbabel/text.h
    • /usr/include/openbabel-2.0/openbabel/tokenst.h
    • /usr/include/openbabel-2.0/openbabel/typer.h
    • /usr/include/openbabel-2.0/openbabel/xml.h
    • /usr/include/openbabel-2.0/openbabel/json/customwriter.h
    • /usr/include/openbabel-2.0/openbabel/json/json-forwards.h
    • /usr/include/openbabel-2.0/openbabel/json/json.h
    • /usr/include/openbabel-2.0/openbabel/math/align.h
    • /usr/include/openbabel-2.0/openbabel/math/erf.h
    • /usr/include/openbabel-2.0/openbabel/math/matrix3x3.h
    • /usr/include/openbabel-2.0/openbabel/math/spacegroup.h
    • /usr/include/openbabel-2.0/openbabel/math/transform3d.h
    • /usr/include/openbabel-2.0/openbabel/math/vector3.h
    • /usr/include/openbabel-2.0/openbabel/stereo/bindings.h
    • /usr/include/openbabel-2.0/openbabel/stereo/cistrans.h
    • /usr/include/openbabel-2.0/openbabel/stereo/squareplanar.h
    • /usr/include/openbabel-2.0/openbabel/stereo/stereo.h
    • /usr/include/openbabel-2.0/openbabel/stereo/tetrahedral.h
    • /usr/include/openbabel-2.0/openbabel/stereo/tetranonplanar.h
    • /usr/include/openbabel-2.0/openbabel/stereo/tetraplanar.h
    • /usr/lib/libinchi.so
    • /usr/lib/libinchi.so.0
    • /usr/lib/libinchi.so.0.4.1
    • /usr/lib/libopenbabel.so
    • /usr/lib/libopenbabel.so.5
    • /usr/lib/libopenbabel.so.5.0.0
    • /usr/lib/cmake/
    • /usr/lib/cmake/openbabel2/OpenBabel2Config.cmake
    • /usr/lib/cmake/openbabel2/OpenBabel2ConfigVersion.cmake
    • /usr/lib/cmake/openbabel2/OpenBabel2_EXPORTS-release.cmake
    • /usr/lib/cmake/openbabel2/OpenBabel2_EXPORTS.cmake
    • /usr/lib/openbabel/
    • /usr/lib/openbabel/2.4.1/APIInterface.so
    • /usr/lib/openbabel/2.4.1/CSRformat.so
    • /usr/lib/openbabel/2.4.1/MCDLformat.so
    • /usr/lib/openbabel/2.4.1/MNAformat.so
    • /usr/lib/openbabel/2.4.1/PQSformat.so
    • /usr/lib/openbabel/2.4.1/abinitformat.so
    • /usr/lib/openbabel/2.4.1/acesformat.so
    • /usr/lib/openbabel/2.4.1/acrformat.so
    • /usr/lib/openbabel/2.4.1/adfformat.so
    • /usr/lib/openbabel/2.4.1/alchemyformat.so
    • /usr/lib/openbabel/2.4.1/amberformat.so
    • /usr/lib/openbabel/2.4.1/aoforceformat.so
    • /usr/lib/openbabel/2.4.1/asciiformat.so
    • /usr/lib/openbabel/2.4.1/balstformat.so
    • /usr/lib/openbabel/2.4.1/bgfformat.so
    • /usr/lib/openbabel/2.4.1/boxformat.so
    • /usr/lib/openbabel/2.4.1/cacaoformat.so
    • /usr/lib/openbabel/2.4.1/cacheformat.so
    • /usr/lib/openbabel/2.4.1/carformat.so
    • /usr/lib/openbabel/2.4.1/castepformat.so
    • /usr/lib/openbabel/2.4.1/cccformat.so
    • /usr/lib/openbabel/2.4.1/cdxmlformat.so
    • /usr/lib/openbabel/2.4.1/chem3dformat.so
    • /usr/lib/openbabel/2.4.1/chemdoodlejsonformat.so
    • /usr/lib/openbabel/2.4.1/chemdrawcdx.so
    • /usr/lib/openbabel/2.4.1/chemdrawct.so
    • /usr/lib/openbabel/2.4.1/chemkinformat.so
    • /usr/lib/openbabel/2.4.1/chemtoolformat.so
    • /usr/lib/openbabel/2.4.1/cifformat.so
    • /usr/lib/openbabel/2.4.1/cmlformat.so
    • /usr/lib/openbabel/2.4.1/cmlreactformat.so
    • /usr/lib/openbabel/2.4.1/confabreport.so
    • /usr/lib/openbabel/2.4.1/copyformat.so
    • /usr/lib/openbabel/2.4.1/crkformat.so
    • /usr/lib/openbabel/2.4.1/crystal09format.so
    • /usr/lib/openbabel/2.4.1/cssrformat.so
    • /usr/lib/openbabel/2.4.1/daltonformat.so
    • /usr/lib/openbabel/2.4.1/dlpolyformat.so
    • /usr/lib/openbabel/2.4.1/dmolformat.so
    • /usr/lib/openbabel/2.4.1/exyzformat.so
    • /usr/lib/openbabel/2.4.1/fastaformat.so
    • /usr/lib/openbabel/2.4.1/fastsearchformat.so
    • /usr/lib/openbabel/2.4.1/fchkformat.so
    • /usr/lib/openbabel/2.4.1/featformat.so
    • /usr/lib/openbabel/2.4.1/fhformat.so
    • /usr/lib/openbabel/2.4.1/fhiaimsformat.so
    • /usr/lib/openbabel/2.4.1/fingerprintformat.so
    • /usr/lib/openbabel/2.4.1/fpsformat.so
    • /usr/lib/openbabel/2.4.1/freefracformat.so
    • /usr/lib/openbabel/2.4.1/gamessformat.so
    • /usr/lib/openbabel/2.4.1/gamessukformat.so
    • /usr/lib/openbabel/2.4.1/gausscubeformat.so
    • /usr/lib/openbabel/2.4.1/gaussformat.so
    • /usr/lib/openbabel/2.4.1/gausszmatformat.so
    • /usr/lib/openbabel/2.4.1/ghemicalformat.so
    • /usr/lib/openbabel/2.4.1/groformat.so
    • /usr/lib/openbabel/2.4.1/gromos96format.so
    • /usr/lib/openbabel/2.4.1/gulpformat.so
    • /usr/lib/openbabel/2.4.1/hinformat.so
    • /usr/lib/openbabel/2.4.1/inchiformat.so
    • /usr/lib/openbabel/2.4.1/jaguarformat.so
    • /usr/lib/openbabel/2.4.1/lmpdatformat.so
    • /usr/lib/openbabel/2.4.1/lpmdformat.so
    • /usr/lib/openbabel/2.4.1/mdffformat.so
    • /usr/lib/openbabel/2.4.1/mdlformat.so
    • /usr/lib/openbabel/2.4.1/mmcifformat.so
    • /usr/lib/openbabel/2.4.1/mmodformat.so
    • /usr/lib/openbabel/2.4.1/mol2format.so
    • /usr/lib/openbabel/2.4.1/moldenformat.so
    • /usr/lib/openbabel/2.4.1/molproformat.so
    • /usr/lib/openbabel/2.4.1/molreport.so
    • /usr/lib/openbabel/2.4.1/mopacformat.so
    • /usr/lib/openbabel/2.4.1/mpdformat.so
    • /usr/lib/openbabel/2.4.1/mpqcformat.so
    • /usr/lib/openbabel/2.4.1/msiformat.so
    • /usr/lib/openbabel/2.4.1/msmsformat.so
    • /usr/lib/openbabel/2.4.1/nulformat.so
    • /usr/lib/openbabel/2.4.1/nwchemformat.so
    • /usr/lib/openbabel/2.4.1/opendxformat.so
    • /usr/lib/openbabel/2.4.1/orcaformat.so
    • /usr/lib/openbabel/2.4.1/outformat.so
    • /usr/lib/openbabel/2.4.1/painterformat.so
    • /usr/lib/openbabel/2.4.1/pcmodelformat.so
    • /usr/lib/openbabel/2.4.1/pdbformat.so
    • /usr/lib/openbabel/2.4.1/pdbqtformat.so
    • /usr/lib/openbabel/2.4.1/plugin_charges.so
    • /usr/lib/openbabel/2.4.1/plugin_descriptors.so
    • /usr/lib/openbabel/2.4.1/plugin_fingerprints.so
    • /usr/lib/openbabel/2.4.1/plugin_forcefields.so
    • /usr/lib/openbabel/2.4.1/plugin_ops.so
    • /usr/lib/openbabel/2.4.1/png2format.so
    • /usr/lib/openbabel/2.4.1/pngformat.so
    • /usr/lib/openbabel/2.4.1/pointcloudformat.so
    • /usr/lib/openbabel/2.4.1/posformat.so
    • /usr/lib/openbabel/2.4.1/povrayformat.so
    • /usr/lib/openbabel/2.4.1/pqrformat.so
    • /usr/lib/openbabel/2.4.1/pubchem.so
    • /usr/lib/openbabel/2.4.1/pubchemjsonformat.so
    • /usr/lib/openbabel/2.4.1/pwscfformat.so
    • /usr/lib/openbabel/2.4.1/qchemformat.so
    • /usr/lib/openbabel/2.4.1/reportformat.so
    • /usr/lib/openbabel/2.4.1/rsmiformat.so
    • /usr/lib/openbabel/2.4.1/rxnformat.so
    • /usr/lib/openbabel/2.4.1/shelxformat.so
    • /usr/lib/openbabel/2.4.1/siestaformat.so
    • /usr/lib/openbabel/2.4.1/smilesformat.so
    • /usr/lib/openbabel/2.4.1/smileyformat.so
    • /usr/lib/openbabel/2.4.1/stlformat.so
    • /usr/lib/openbabel/2.4.1/svgformat.so
    • /usr/lib/openbabel/2.4.1/textformat.so
    • /usr/lib/openbabel/2.4.1/thermoformat.so
    • /usr/lib/openbabel/2.4.1/tinkerformat.so
    • /usr/lib/openbabel/2.4.1/titleformat.so
    • /usr/lib/openbabel/2.4.1/turbomoleformat.so
    • /usr/lib/openbabel/2.4.1/unichemformat.so
    • /usr/lib/openbabel/2.4.1/vaspformat.so
    • /usr/lib/openbabel/2.4.1/viewmolformat.so
    • /usr/lib/openbabel/2.4.1/xedformat.so
    • /usr/lib/openbabel/2.4.1/xmlformat.so
    • /usr/lib/openbabel/2.4.1/xsfformat.so
    • /usr/lib/openbabel/2.4.1/xtcformat.so
    • /usr/lib/openbabel/2.4.1/xyzformat.so
    • /usr/lib/openbabel/2.4.1/yasaraformat.so
    • /usr/lib/openbabel/2.4.1/zindoformat.so
    • /usr/lib/pkgconfig/openbabel-2.0.pc
    • /usr/share/
    • /usr/share/man/
    • /usr/share/man/man1/babel.1.gz
    • /usr/share/man/man1/obabel.1.gz
    • /usr/share/man/man1/obchiral.1.gz
    • /usr/share/man/man1/obconformer.1.gz
    • /usr/share/man/man1/obenergy.1.gz
    • /usr/share/man/man1/obfit.1.gz
    • /usr/share/man/man1/obgen.1.gz
    • /usr/share/man/man1/obgrep.1.gz
    • /usr/share/man/man1/obgui.1.gz
    • /usr/share/man/man1/obminimize.1.gz
    • /usr/share/man/man1/obprobe.1.gz
    • /usr/share/man/man1/obprop.1.gz
    • /usr/share/man/man1/obrotamer.1.gz
    • /usr/share/man/man1/obrotate.1.gz
    • /usr/share/man/man1/obspectrophore.1.gz
    • /usr/share/man/man1/roundtrip.1.gz
    • /usr/share/openbabel/
    • /usr/share/openbabel/2.4.1/MACCS.txt
    • /usr/share/openbabel/2.4.1/SMARTS_InteLigand.txt
    • /usr/share/openbabel/2.4.1/UFF.prm
    • /usr/share/openbabel/2.4.1/aromatic.txt
    • /usr/share/openbabel/2.4.1/atomization-energies.txt
    • /usr/share/openbabel/2.4.1/atomtyp.txt
    • /usr/share/openbabel/2.4.1/babel_povray3.inc
    • /usr/share/openbabel/2.4.1/bondtyp.txt
    • /usr/share/openbabel/2.4.1/eem.txt
    • /usr/share/openbabel/2.4.1/eem2015ba.txt
    • /usr/share/openbabel/2.4.1/eem2015bm.txt
    • /usr/share/openbabel/2.4.1/eem2015bn.txt
    • /usr/share/openbabel/2.4.1/eem2015ha.txt
    • /usr/share/openbabel/2.4.1/eem2015hm.txt
    • /usr/share/openbabel/2.4.1/eem2015hn.txt
    • /usr/share/openbabel/2.4.1/element.txt
    • /usr/share/openbabel/2.4.1/eqeqIonizations.txt
    • /usr/share/openbabel/2.4.1/fragments.txt
    • /usr/share/openbabel/2.4.1/gaff.dat
    • /usr/share/openbabel/2.4.1/gaff.prm
    • /usr/share/openbabel/2.4.1/ghemical.prm
    • /usr/share/openbabel/2.4.1/isotope-small.txt
    • /usr/share/openbabel/2.4.1/isotope.txt
    • /usr/share/openbabel/2.4.1/logp.txt
    • /usr/share/openbabel/2.4.1/mmff94.ff
    • /usr/share/openbabel/2.4.1/mmff94s.ff
    • /usr/share/openbabel/2.4.1/mmffang.par
    • /usr/share/openbabel/2.4.1/mmffbndk.par
    • /usr/share/openbabel/2.4.1/mmffbond.par
    • /usr/share/openbabel/2.4.1/mmffchg.par
    • /usr/share/openbabel/2.4.1/mmffdef.par
    • /usr/share/openbabel/2.4.1/mmffdfsb.par
    • /usr/share/openbabel/2.4.1/mmffoop.par
    • /usr/share/openbabel/2.4.1/mmffpbci.par
    • /usr/share/openbabel/2.4.1/mmffprop.par
    • /usr/share/openbabel/2.4.1/mmffs_oop.par
    • /usr/share/openbabel/2.4.1/mmffs_tor.par
    • /usr/share/openbabel/2.4.1/mmffstbn.par
    • /usr/share/openbabel/2.4.1/mmfftor.par
    • /usr/share/openbabel/2.4.1/mmffvdw.par
    • /usr/share/openbabel/2.4.1/mpC.txt
    • /usr/share/openbabel/2.4.1/mr.txt
    • /usr/share/openbabel/2.4.1/patterns.txt
    • /usr/share/openbabel/2.4.1/phmodel.txt
    • /usr/share/openbabel/2.4.1/plugindefines.txt
    • /usr/share/openbabel/2.4.1/psa.txt
    • /usr/share/openbabel/2.4.1/qeq.txt
    • /usr/share/openbabel/2.4.1/resdata.txt
    • /usr/share/openbabel/2.4.1/ringtyp.txt
    • /usr/share/openbabel/2.4.1/space-groups.txt
    • /usr/share/openbabel/2.4.1/splash.png
    • /usr/share/openbabel/2.4.1/superatom.txt
    • /usr/share/openbabel/2.4.1/svgformat.script
    • /usr/share/openbabel/2.4.1/templates.sdf
    • /usr/share/openbabel/2.4.1/torlib.txt
    • /usr/share/openbabel/2.4.1/types.txt
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