MolMine
iCon
D-Gen
iCon
Input Format
acr--ACR format
alc--ALC Format
arc--Accelrys/MSI Biosym/Insight II CAR format
bgf--MSI BGF format
box--Dock 3.5 Box format
bs--Ball and Stick format
c3d1 -- Chem3D Cartesian 1 format
c3d2 -- Chem3D Cartesian 2 format
caccrt--Cacao Cartesian format
can--Canonical SMILES format
car--Accelrys/MSI Biosym/Insight II CAR format
ccc--CCC format
cdx--ChemDraw binary format
cdxml--ChemDraw CDXML format
cif--Crystallographic Information File
cml--Chemical Markup Language
cmlr--CML Reaction format
crk2d--Chemical Resource Kit 2D diagram format
rk3d--Chemical Resource Kit 3D format
ct--ChemDraw Connection Table format
dmol--DMol3 coordinates format
ent--Protein Data Bank format
fch -- Gaussian formatted checkpoint file format
fchk--Gaussian formatted checkpoint file format
fck--Gaussian formatted checkpoint file format
feat--Feature format
fract--Free Form Fractional format
fs--Open Babel FastSearching database
g03 -- Gaussian 98/03 Output [Read-only]
g98 -- Gaussian 98/03 Output
gam -- GAMESS Output
gamout -- GAMESS Output
gpr--Ghemical format
hin--HyperChem HIN format
ins--ShelX format
jout--Jaguar output format
mdl--MDL MOL format
mmd--MacroModel format
mmod--MacroModel format
mol--MDL MOL format
mol2--Sybyl Mol2 format
moo--MOPAC Output format
mop--MOPAC Cartesian format
mopcrt--MOPAC Cartesian format
mopin--MOPAC Internal
mopout--MOPAC Output format
mpc--MOPAC Cartesian format
nwo--NWChem output format
pc--PubChem format
pcm--PCModel format
pdb--Protein Data Bank format
pqs--Parallel Quantum Solutions format
prep--Amber Prep format
qcout--Q-Chem output format
res-- ShelX format
rxn--MDL RXN format
sd--MDL MOL format
sdf--MDL MOL format
smi--SMILES format
sy2 -- Sybyl Mol2 format
tdd--Thermo format
therm--Thermo format
tmol--TurboMole Coordinate format
unixyz--UniChem XYZ format
vmol--ViewMol format
xml--General XML format
yz--XYZ cartesian coordinates format
yob--YASARA.org YOB format
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Output Format
alc--Alchemy format
bgf--MSI BGF format
box--Dock 3.5 Box format
bs--Ball and Stick format
c3d1--Chem3D Cartesian 1 format
c3d2--Chem3D Cartesian 2 format
caccrt--Cacao Cartesian format
cache--CAChe MolStruct format
cacint--Cacao Internal format [
can--Canonical SMILES format
cdxml--ChemDraw CDXML format
cht--Chemtool format
cif--Crystallographic Information File
cml--Chemical Markup Language
cmlr--CML Reaction format
com--Gaussian 98/03 Cartesian Input
copy--Copies raw text [
crk2d--Chemical Resource Kit 2D diagram format
crk3d--Chemical Resource Kit 3D format
csr--Accelrys/MSI Quanta CSR format
cssr--CSD CSSR format
ct--ChemDraw Connection Table format
dmol--DMol3 coordinates format
ent--Protein Data Bank format
fa--FASTA format
fasta--FASTA format
feat--Feature format
fh--Fenske-Hall Z-Matrix format
fix--SMILES FIX format
fpt--Fingerprint format
fract--Free Form Fractional format
fs--Open Babel FastSearching database
fsa--FASTA format
gamin--GAMESS Input
gau--Gaussian 98/03 Cartesian Input
gjc--Gaussian 98/03 Cartesian Input
gjf--Gaussian 98/03 Cartesian Input
gpr--Ghemical format
gr96--GROMOS96 format
hin--HyperChem HIN format
inchi--IUPAC InChI
inp--GAMESS Input
jin--Jaguar input format
mdl--MDL MOL format
mmd--MacroModel format
mmod--MacroModel format
mol--MDL MOL format
mol2--Sybyl Mol2 format
molreport--Open Babel molecule report
mop--MOPAC Cartesian format
mopcrt--MOPAC Cartesian format
mopin--MOPAC Internal
mpc--MOPAC Cartesian format
mpd--Sybyl descriptor format
mpqcin--MPQC simplified input format
nw--NWChem input format
pcm--PCModel format
pdb--Protein Data Bank format
pov--POV-Ray input format
pqs--Parallel Quantum Solutions format
qcin--Q-Chem input format
report--Open Babel report format
rxn--MDL RXN format
sd--MDL MOL format
sdf--MDL MOL format
smi--SMILES format
sy2--Sybyl Mol2 format
tdd--Thermo format
test--Test format
therm--Thermo format
tmol--TurboMole Coordinate format
txyz--Tinker MM2 format
unixyz--UniChem XYZ format
vmol--ViewMol format
xed--XED format
xyz--XYZ cartesian coordinates format
yob--YASARA.org YOB format
zin--ZINDO input format
Output File Name
E-mail
(optional)
IBI Biosolutions Pvt. Ltd