With its current 1.3 version, it is able to
- Graphic User Interface to build the main simulation input file.
- Simulation Manager to lead the multi-scale simulation between different Calculation Units.
- Interface with Amber v10
- Interface with DLPOLY v2.18
- Interface with Gaussian03
- Interface with deMon2k
- Interface with NWChem
- Interface with Siesta v2.0 (Start/Stop and CycleQM behaviors)
- Interface with mndo97 (Start/Stop QM role behaviors)
- stubMD. Stub program for interface sample and testing playing a Molecular Dynamics Calculation Unit role.
- stubQM. Stub program for interface sample and testing, playing a Cycle Quantum Mechanics Calculation Unit role.
- stubDI. Stub program for interface sample and testing, playing an external Domain Identifier Calculation Unit role.