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Artificial light harvesting dye (C8S3) for Martini 3
The parameters are for an artificial light harvesting dye (C8S3) which self-assembles into hollow nanotubes. Included are a gro and an itp for C8S3, a unit cell of the brickwork and herringbone formation, the script to make the cylinders, one nanotube and a bundle.
Details can be found in the publication: - Patmanidis et al., Nanoscale Advances, 2022, in press.
An extended collection of Martini 3 models for small molecules is now available here (R. Alessandri, et al., Adv. Theory Simul., 2022).