SCIGRESS for Students
- This Task has been designed for use by Students. For Students
A state-of-the-art molecular builder and visualizer enables the researcher to import experiment structures using a variety of industry standard formats, or to build novel structures using a multi-function tool palette. SCIGRESS has the unique ability to apply a wide range of computational models, from molecular mechanics through rigorous quantum electronic structure techniques, to all types of molecular systems, from organic molecules, to inorganics, polymers, materials systems (metals, oxides, ceramics, semiconductors), and whole proteins. SCIGRESS is a successor of Computer Aided Chemistry (CAChe) and Materials Explorer and integrates both programs into one powerful suite.