 ../
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isotope.hpp
|
2440
(18 years ago)
by tim:
adding openbabel
|
|
matrix.cpp
|
2440
(18 years ago)
by tim:
adding openbabel
|
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kekulize.cpp
|
2440
(18 years ago)
by tim:
adding openbabel
|
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mol.cpp
|
2440
(18 years ago)
by tim:
adding openbabel
|
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obmolecformat.hpp
|
2440
(18 years ago)
by tim:
adding openbabel
|
|
transform.cpp
|
2440
(18 years ago)
by tim:
adding openbabel
|
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rand.cpp
|
2440
(18 years ago)
by tim:
adding openbabel
|
|
grid.cpp
|
2440
(18 years ago)
by tim:
adding openbabel
|
|
parsmart.hpp
|
2440
(18 years ago)
by tim:
adding openbabel
|
|
resdata.hpp
|
2440
(18 years ago)
by tim:
adding openbabel
|
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obiter.hpp
|
2440
(18 years ago)
by tim:
adding openbabel
|
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ring.hpp
|
2440
(18 years ago)
by tim:
adding openbabel
|
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atom.cpp
|
2440
(18 years ago)
by tim:
adding openbabel
|
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strncasecmp.c
|
2440
(18 years ago)
by tim:
adding openbabel
|
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bondtyp.hpp
|
2440
(18 years ago)
by tim:
adding openbabel
|
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torlib.hpp
|
2440
(18 years ago)
by tim:
adding openbabel
|
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molchrg.hpp
|
2440
(18 years ago)
by tim:
adding openbabel
|
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snprintf.c
|
2440
(18 years ago)
by tim:
adding openbabel
|
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bond.cpp
|
2440
(18 years ago)
by tim:
adding openbabel
|
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snprintf.h
|
2440
(18 years ago)
by tim:
adding openbabel
|
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extable.hpp
|
2440
(18 years ago)
by tim:
adding openbabel
|
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molchrg.cpp
|
2440
(18 years ago)
by tim:
adding openbabel
|
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bondtyper.hpp
|
2440
(18 years ago)
by tim:
adding openbabel
|
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vector3.cpp
|
2440
(18 years ago)
by tim:
adding openbabel
|
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phmodel.hpp
|
2440
(18 years ago)
by tim:
adding openbabel
|
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ring.cpp
|
2440
(18 years ago)
by tim:
adding openbabel
|
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reaction.hpp
|
2440
(18 years ago)
by tim:
adding openbabel
|
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matrix3x3.cpp
|
2440
(18 years ago)
by tim:
adding openbabel
|
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bitvec.cpp
|
2440
(18 years ago)
by tim:
adding openbabel
|
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parsmart.cpp
|
2440
(18 years ago)
by tim:
adding openbabel
|
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chains.cpp
|
2440
(18 years ago)
by tim:
adding openbabel
|
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rotamer.cpp
|
2440
(18 years ago)
by tim:
adding openbabel
|
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rotor.hpp
|
2440
(18 years ago)
by tim:
adding openbabel
|
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matrix3x3.hpp
|
2440
(18 years ago)
by tim:
adding openbabel
|
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rotamer.hpp
|
2440
(18 years ago)
by tim:
adding openbabel
|
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chains.hpp
|
2440
(18 years ago)
by tim:
adding openbabel
|
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zipstream.hpp
|
2440
(18 years ago)
by tim:
adding openbabel
|
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generic.cpp
|
2440
(18 years ago)
by tim:
adding openbabel
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typer.hpp
|
2440
(18 years ago)
by tim:
adding openbabel
|
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element.hpp
|
2440
(18 years ago)
by tim:
adding openbabel
|
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vector3.hpp
|
2440
(18 years ago)
by tim:
adding openbabel
|
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aromatic.hpp
|
2440
(18 years ago)
by tim:
adding openbabel
|
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phmodeldata.hpp
|
2440
(18 years ago)
by tim:
adding openbabel
|
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atomtyp.hpp
|
2440
(18 years ago)
by tim:
adding openbabel
|
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chiral.cpp
|
2440
(18 years ago)
by tim:
adding openbabel
|
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types.hpp
|
2440
(18 years ago)
by tim:
adding openbabel
|
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obiter.cpp
|
2440
(18 years ago)
by tim:
adding openbabel
|
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zipstreamimpl.hpp
|
2440
(18 years ago)
by tim:
adding openbabel
|
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patty.hpp
|
2440
(18 years ago)
by tim:
adding openbabel
|
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chiral.hpp
|
2440
(18 years ago)
by tim:
adding openbabel
|
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obconversion.lo
|
2440
(18 years ago)
by tim:
adding openbabel
|
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amberformat.cpp
|
2445
(18 years ago)
by tim:
adding more readers/writers
|
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fingerprintformat.hpp
|
2445
(18 years ago)
by tim:
adding more readers/writers
|
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povrayformat.cpp
|
2445
(18 years ago)
by tim:
adding more readers/writers
|
|
Makefile
|
2445
(18 years ago)
by tim:
adding more readers/writers
|
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gromos96format.hpp
|
2445
(18 years ago)
by tim:
adding more readers/writers
|
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fingerprintformat.cpp
|
2445
(18 years ago)
by tim:
adding more readers/writers
|
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xyzformat.cpp
|
2445
(18 years ago)
by tim:
adding more readers/writers
|
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tinkerformat.cpp
|
2445
(18 years ago)
by tim:
adding more readers/writers
|
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gromos96format.cpp
|
2445
(18 years ago)
by tim:
adding more readers/writers
|
|
amberformat.hpp
|
2445
(18 years ago)
by tim:
adding more readers/writers
|
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smilesformat.hpp
|
2445
(18 years ago)
by tim:
adding more readers/writers
|
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xyzformat.hpp
|
2445
(18 years ago)
by tim:
adding more readers/writers
|
|
fingerprint.hpp
|
2445
(18 years ago)
by tim:
adding more readers/writers
|
|
tinkerformat.hpp
|
2445
(18 years ago)
by tim:
adding more readers/writers
|
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pdbformat.cpp
|
2445
(18 years ago)
by tim:
adding more readers/writers
|
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grid.hpp
|
2450
(18 years ago)
by gezelter:
Unifying config.h stuff and making sure the OpenBabel codes can find
our default (and environment variable) Force Field directories.
|
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typer.cpp
|
2450
(18 years ago)
by gezelter:
Unifying config.h stuff and making sure the OpenBabel codes can find
our default (and environment variable) Force Field directories.
|
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bitvec.hpp
|
2450
(18 years ago)
by gezelter:
Unifying config.h stuff and making sure the OpenBabel codes can find
our default (and environment variable) Force Field directories.
|
|
generic.hpp
|
2450
(18 years ago)
by gezelter:
Unifying config.h stuff and making sure the OpenBabel codes can find
our default (and environment variable) Force Field directories.
|
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smilesformat.cpp
|
2450
(18 years ago)
by gezelter:
Unifying config.h stuff and making sure the OpenBabel codes can find
our default (and environment variable) Force Field directories.
|
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phmodel.cpp
|
2450
(18 years ago)
by gezelter:
Unifying config.h stuff and making sure the OpenBabel codes can find
our default (and environment variable) Force Field directories.
|
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oberror.hpp
|
2450
(18 years ago)
by gezelter:
Unifying config.h stuff and making sure the OpenBabel codes can find
our default (and environment variable) Force Field directories.
|
|
mol.hpp
|
2450
(18 years ago)
by gezelter:
Unifying config.h stuff and making sure the OpenBabel codes can find
our default (and environment variable) Force Field directories.
|
|
obutil.hpp
|
2450
(18 years ago)
by gezelter:
Unifying config.h stuff and making sure the OpenBabel codes can find
our default (and environment variable) Force Field directories.
|
|
rotor.cpp
|
2450
(18 years ago)
by gezelter:
Unifying config.h stuff and making sure the OpenBabel codes can find
our default (and environment variable) Force Field directories.
|
|
data.cpp
|
2450
(18 years ago)
by gezelter:
Unifying config.h stuff and making sure the OpenBabel codes can find
our default (and environment variable) Force Field directories.
|
|
tokenst.cpp
|
2450
(18 years ago)
by gezelter:
Unifying config.h stuff and making sure the OpenBabel codes can find
our default (and environment variable) Force Field directories.
|
|
obutil.cpp
|
2450
(18 years ago)
by gezelter:
Unifying config.h stuff and making sure the OpenBabel codes can find
our default (and environment variable) Force Field directories.
|
|
obconversion.hpp
|
2450
(18 years ago)
by gezelter:
Unifying config.h stuff and making sure the OpenBabel codes can find
our default (and environment variable) Force Field directories.
|
|
pdbformat.hpp
|
2450
(18 years ago)
by gezelter:
Unifying config.h stuff and making sure the OpenBabel codes can find
our default (and environment variable) Force Field directories.
|
|
matrix.hpp
|
2450
(18 years ago)
by gezelter:
Unifying config.h stuff and making sure the OpenBabel codes can find
our default (and environment variable) Force Field directories.
|
|
oberror.cpp
|
2450
(18 years ago)
by gezelter:
Unifying config.h stuff and making sure the OpenBabel codes can find
our default (and environment variable) Force Field directories.
|
|
base.cpp
|
2450
(18 years ago)
by gezelter:
Unifying config.h stuff and making sure the OpenBabel codes can find
our default (and environment variable) Force Field directories.
|
|
residue.cpp
|
2450
(18 years ago)
by gezelter:
Unifying config.h stuff and making sure the OpenBabel codes can find
our default (and environment variable) Force Field directories.
|
|
base.hpp
|
2450
(18 years ago)
by gezelter:
Unifying config.h stuff and making sure the OpenBabel codes can find
our default (and environment variable) Force Field directories.
|
|
patty.cpp
|
2450
(18 years ago)
by gezelter:
Unifying config.h stuff and making sure the OpenBabel codes can find
our default (and environment variable) Force Field directories.
|
|
fingerprint.cpp
|
2450
(18 years ago)
by gezelter:
Unifying config.h stuff and making sure the OpenBabel codes can find
our default (and environment variable) Force Field directories.
|
|
data.hpp
|
2450
(18 years ago)
by gezelter:
Unifying config.h stuff and making sure the OpenBabel codes can find
our default (and environment variable) Force Field directories.
|
|
bondtyper.cpp
|
2450
(18 years ago)
by gezelter:
Unifying config.h stuff and making sure the OpenBabel codes can find
our default (and environment variable) Force Field directories.
|
|
povrayformat.hpp
|
2450
(18 years ago)
by gezelter:
Unifying config.h stuff and making sure the OpenBabel codes can find
our default (and environment variable) Force Field directories.
|
|
obconversion.cpp
|
2454
(18 years ago)
by gezelter:
fixed a bug
|
|
oopseformat.hpp
|
2455
(18 years ago)
by tim:
rename mdinConverter to atom2mdin
|
|
oopseformat.cpp
|
2458
(18 years ago)
by tim:
adding support for soft linking
|
