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Collection of MD simulations using HOOMD blue

Generation of de novo library sequences for oligonucleotide library synthesis.

A Python 3 script that uses ETE3 to visualize results of CAFE (Computational Analysis of gene Family Evolution).

pyMOR - Model Order Reduction with Python

Visualizing the influences of structural features on molecular property prediction with explainable artificial intelligence and evolutionary multiple pattern fingerprints. Project based on Evo-MPF, SHAP and Catboost libaries.