Category:計算化学ソフトウェア

MOPAC

Ribbon diagram

Scigress

AMPAC

Dirac (software)

GAMESS

Amsterdam Density Functional

CRYSTAL (software)

Firefly (computer program)

GAMESS (UK)

GAMESS (US)

Open Babel

ORCA (quantum chemistry program)

PSI (computational chemistry)

Quantum ESPRESSO

Vienna Ab initio Simulation Package

Avogadro (software)

TURBOMOLE

Spartan (chemistry software)

CHELPG

ABINIT

Gabedit

MOLCAS