QM/MD Software Tier List

Drag software logos to rank them.
Once you've arranged them, click "Submit Vote" to record your rankings and see other users' votes.

S
A
B
C
NA
VASPVASP
GaussianGaussian
ORCAORCA
Q-ChemQ-Chem
Psi4Psi4
CP2KCP2K
QEQE
JDFTxJDFTx
GPAWGPAW
BerkeleyGWBerkeleyGW
LAMMPSLAMMPS
GROMACSGROMACS
AMBERAMBER
OpenMMOpenMM
PLUMEDPLUMED
ASEASE
PymatgenPymatgen
RDKitRDKit
AiiDAAiiDA
AtomateAtomate
JobflowJobflow
FairChemFairChem
QuAccQuAcc