Adaptive CVgen Enhances Protein Folding

This is a news story, published by Phys Org, that relates primarily to Adaptive Collective Variables Generator news.

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Traditional molecular dynamics methods

Phys Org

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Advanced sampling method can track dynamic evolution of protein folding

Summary

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A new reinforcement learning-based enhanced sampling method called Adaptive Collective Variables Generator (Adaptive CVgen ) has been successfully applied to study protein folding and the synthesis of fullerene ( C60 ) Understanding the dynamic evolution of microscopic systems has been one of the biggest challenges in fundamental research, which plays a key role in areas like protein folding.

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