Quantum-machine-assisted Drug Discovery

Fuente: arXiv
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Bibliographic Details
Main Authors: Zhou, Yidong, Chen, Jintai, Cheng, Jinglei, Cao, Xu, Zhang, Yuanyuan, Karemore, Gopal, Zitnik, Marinka, Chong, Frederic T., Liu, Junyu, Fu, Tianfan, Liang, Zhiding
Format: Preprint
Published: 2024
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author Zhou, Yidong
Chen, Jintai
Cheng, Jinglei
Cao, Xu
Zhang, Yuanyuan
Karemore, Gopal
Zitnik, Marinka
Chong, Frederic T.
Liu, Junyu
Fu, Tianfan
Liang, Zhiding
author_facet Zhou, Yidong
Chen, Jintai
Cheng, Jinglei
Cao, Xu
Zhang, Yuanyuan
Karemore, Gopal
Zitnik, Marinka
Chong, Frederic T.
Liu, Junyu
Fu, Tianfan
Liang, Zhiding
contents Drug discovery is lengthy and expensive, with traditional computer-aided design facing limits. This paper examines integrating quantum computing across the drug development cycle to accelerate and enhance workflows and rigorous decision-making. It highlights quantum approaches for molecular simulation, drug-target interaction prediction, and optimizing clinical trials. Leveraging quantum capabilities could accelerate timelines and costs for bringing therapies to market, improving efficiency and ultimately benefiting public health.
format Preprint
id arxiv_https___arxiv_org_abs_2408_13479
institution arXiv
publishDate 2024
record_format arxiv
spellingShingle Quantum-machine-assisted Drug Discovery
Zhou, Yidong
Chen, Jintai
Cheng, Jinglei
Cao, Xu
Zhang, Yuanyuan
Karemore, Gopal
Zitnik, Marinka
Chong, Frederic T.
Liu, Junyu
Fu, Tianfan
Liang, Zhiding
Quantum Physics
Machine Learning
Biomolecules
Drug discovery is lengthy and expensive, with traditional computer-aided design facing limits. This paper examines integrating quantum computing across the drug development cycle to accelerate and enhance workflows and rigorous decision-making. It highlights quantum approaches for molecular simulation, drug-target interaction prediction, and optimizing clinical trials. Leveraging quantum capabilities could accelerate timelines and costs for bringing therapies to market, improving efficiency and ultimately benefiting public health.
title Quantum-machine-assisted Drug Discovery
topic Quantum Physics
Machine Learning
Biomolecules
url https://arxiv.org/abs/2408.13479