Category:計算化学ソフトウェア
HyperChem
MOPAC
MOPACScigress
ScigressATOMCI
TANPAKU
リボンダイアグラム
Ribbon diagramNTChem
AMPAC
AMPACDIRAC
Dirac (software)GAMESS
GAMESSAmsterdam Density Functional
Amsterdam Density FunctionalCRYSTAL (ソフトウェア)
CRYSTAL (software)Firefly (プログラム)
Firefly (computer program)GAMESS (UK)
GAMESS (UK)GAMESS (US)
GAMESS (US)Open Babel
Open BabelORCA (量子化学プログラム)
ORCA (quantum chemistry program)PAICS
PSI (ソフトウェア)
PSI (computational chemistry)Quantum ESPRESSO
Quantum ESPRESSOVienna Ab initio Simulation Package
Vienna Ab initio Simulation PackageTURBOMOLE
TURBOMOLESpartan
Spartan (chemistry software)CHELPG
CHELPGABINIT
ABINITGabedit
GabeditMOLCAS
MOLCASAvogadro
Avogadro (software)