 |
      |
     |
|
 |
Multi-purpose Molecular Dynamics Package for Windows
Materials Explorer aids your research in:
- Organics, polymers, biomolecules, metals, ceramics, semiconductors, etc.
- Crystals, amorphous solids, liquids and gases (periodic
boundaries)
- Phase transitions, expansion, compressibility, tensile strength, defects, etc.
Easy to use
Point-and-click operation and an intuitive graphical interface make it simple to build assemblies of molecules in a cell, to set up the calculations, and to interpret the results.
Full MD Engine Included
Temperature and pressure-controlled MD simulations are available by employing the Parrinello-Rahman and Nose methods. A velocity-scaling method is also available for controlled temperatures. Both the SHAKE algorithm and the rigid-body treatment can also be applied to molecular systems.
Ready for Large Systems
Materials Explorer for Windows can easily interface with vector- and SPP-type UNIX-machines to run high performance calculations for very large systems. Highly vectorized and parallelized MD module options are available for such applications.
Learn more...
|
