PyAPM is an open-source Python tool for automated generation of amorphous polymer models from SMILES strings. It supports both all-atom (AA) and coarse-grained (CG) modeling, enabling multiscale ...
Otaniemi Center for Atomic-scale Materials Modeling (OCAMM), hosted by the Department of Chemistry and Materials Science (CMAT). The positions to be filled are part of a new project funded by Business ...
Try out the examples in the examples folder using the binder service. The package can also be installed on Google Colab using the commands: The easiest way to get started with the Control Systems ...
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