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Quantum computing exploration for drug discovery on AWS

Yong Liu, Aoyu Zhang, Mengxin Zhu
2022
Last updated October 13, 2023
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Quantum Computing Exploration for Drug Discovery on AWS (abbrev. QCEDD), an open-sourced solution customers can launch to design and run computational studies in the area of drug discovery, e.g. molecular docking and protein folding. With this AWS Solution, you can access quantum computers through Amazon Braket. The Amazon Braket Hybrid Job feature allows you to use classical computing and quantum computing resources to evaluate experiment values such as cost, time, and performance. The AWS Solution comes with built-in sample code for certain drug discovery problems, such as molecular docking, protein folding, RNA folding, and retrosynthetic planning, to help you get started with quantum computing in the field.

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