Category:計算化学ソフトウェア

Gaussian (software)

Ribbon diagram

Winmostar

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

CHELPG

ABINIT

Avogadro (software)

Gabedit

MOLCAS