The multifunctional software for materials modelling, simulations and analysis. The software has to enable, creation, 3D visualization, simulations (at least Molecular Dynamics approach (MD – with the possibility to use at least common ensembles i.e. NVE, NVT, NPT), Monte Carlo (MC) possibility is of course welcomed) and analyses of computer models of the molecular systems composed of wide variety of molecular structures like polymers (linear, branched, dendrimers), solid surfaces including crystalline ones, solvents and many other custom molecules/molecular systems (e.g. carbon nanotubes) or molecules created “atom-by-atom” using a proper “drawing tool” which has to be a part of the given software molecular builder framework.
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