Biomolecular Physics

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Study question Can infertility diagnosis and sperm selection be improved by using bio- nanotechnologies? Summary answer Gold nanoparticle integrated biopolymeric scaffolds show good biocompatibility when interacting with human sperm cells, being suitable to be used as cell sorting and biosensing platforms. What is known already Microfluidic platforms are used in sperm selection for increasing the in-vitro fertilization success but they are limited by the exclusive analysis of sperm cell motility.

Abstract FSATOOL is an integrated molecular simulation and data analysis program. Its old molecular dynamics engine only supports simulations in vacuum or implicit solvent. In this work, we implement the well-known smooth particle mesh Ewald method for simulations in explicit solvent. The new developed engine is runnable on both CPU and GPU. All the existed analysis modules in the program are compatible with the new engine. Moreover, we also build a complete deep learning module in FSATOOL.