Category:計算化学ソフトウェア

Gaussian (software)

Ribbon diagram

ABINIT

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)

TURBOMOLE

Quantum ESPRESSO

Vienna Ab initio Simulation Package

Winmostar

CHELPG

Gabedit

MOLCAS

Avogadro (software)