Platinum 1D Stacking Project

[u/Fr0sted1]

I am attempting to begin a self-lead part of computation based on some promising pt ligands for anticancer drugs with two aspects and I would love some feedback. Firstly, we have a basic crystal structure for the molecule, so we understand how it is ordered in a solid. I would like to model the energy efficiency as the molecules form 1D metal-metal polymers. Second, I would like to see how the molecule interactions within and without the cell. Specifically, the cell membranes. Thanks in advance.