Comparison of nucleic acid simulation software
This is a list of computer programs that are used for nucleic acids simulations.
Name | View 3D | Model build | Min | MD | MC | REM | Crt | Int | Exp | Imp | Lig | GPU | Comments | License | Website |
Abalone | DNA, proteins, ligands | ||||||||||||||
AMBER | AMBER force field | ||||||||||||||
Ascalaph Designer | AMBER | , GPL | |||||||||||||
CHARMM | CHARMM force field | ||||||||||||||
CP2K | , GPL | ||||||||||||||
Forecaster | Small molecule docking to nucleic acids with water placement | Free for academia, Proprietary | |||||||||||||
HyperChem | some force fields | ||||||||||||||
ICM | Global optimization | ||||||||||||||
JUMNA | |||||||||||||||
MDynaMix | Common MD | , GPL | |||||||||||||
Molecular Operating Environment | |||||||||||||||
Nucleic Acid Builder | Generates models for unusual DNA, RNA | , GPL | |||||||||||||
NAnoscale Molecular Dynamics | Fast, parallel MD, CUDA | ||||||||||||||
oxDNA | Coarse-grained models of DNA, RNA | , GPL | |||||||||||||
QRNAS | High resolution refinement of models of RNA, DNA and hybrids using AMBER force field. | , GPL | |||||||||||||
SimRNA | Coarse grained modeling of RNA | Free for Academic, Proprietary | |||||||||||||
SimRNAweb | Coarse grained modeling of RNA | Free | |||||||||||||
YASARA | Interactive simulations |