Category:計算化学ソフトウェア

MOPAC

Scigress

Ribbon diagram

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

TURBOMOLE

Spartan (chemistry software)

CHELPG

ABINIT

Gabedit

MOLCAS

Avogadro (software)