A brief review on quantum computing based drug design
The result's identifiers
Result code in IS VaVaI
<a href="https://www.isvavai.cz/riv?ss=detail&h=RIV%2F61989100%3A27240%2F24%3A10256314" target="_blank" >RIV/61989100:27240/24:10256314 - isvavai.cz</a>
Alternative codes found
RIV/61989100:27740/24:10256314
Result on the web
<a href="https://wires.onlinelibrary.wiley.com/doi/10.1002/widm.1553" target="_blank" >https://wires.onlinelibrary.wiley.com/doi/10.1002/widm.1553</a>
DOI - Digital Object Identifier
<a href="http://dx.doi.org/10.1002/widm.1553" target="_blank" >10.1002/widm.1553</a>
Alternative languages
Result language
angličtina
Original language name
A brief review on quantum computing based drug design
Original language description
Design and development of new drug molecules are essential for the survival of human society. New drugs are designed for therapeutic purposes to combat new diseases. Besides treating new diseases, new drug development is also needed to treat pre-existing diseases more effectively and reduce the existing drugs' side effects. The design of drugs involves several steps, from the discovery of the drug molecule to its commercialization in the market. One of the most critical steps in drug design is to find the molecular interactions between the target (infected) molecule and the drug molecule. Several complex chemical equations need to be solved to determine the molecular interactions. In the late 20th Century, the advancement of computational technologies has made the solution of chemical equations relatively easier and faster. Moreover, the design of drug molecules involves multi-criteria optimization. Classical computational methodologies have been used for drug design since the end of the 20th Century. However, nowadays, more advanced computational methodologies are inevitable in designing drugs for new diseases and drugs with fewer side effects. In this context, the quantum computing paradigm has proved beneficial in drug design due to its advanced computational capabilities. This paper presents a state-of-the-art comprehensive review of the quantum computing-based methodologies involved in drug design. A comparative study is made about the different quantum-aided drug design methods, stating each methodology's merits and demerits. The review work presented in this manuscript will help new researchers assess the present state-of-the-art concept of quantum-based drug design. This article is categorized under: Technologies > Structure Discovery and Clustering Technologies > Computational Intelligence Application Areas > Health Care
Czech name
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Czech description
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Classification
Type
J<sub>imp</sub> - Article in a specialist periodical, which is included in the Web of Science database
CEP classification
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OECD FORD branch
10201 - Computer sciences, information science, bioinformathics (hardware development to be 2.2, social aspect to be 5.8)
Result continuities
Project
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Continuities
O - Projekt operacniho programu
Others
Publication year
2024
Confidentiality
S - Úplné a pravdivé údaje o projektu nepodléhají ochraně podle zvláštních právních předpisů
Data specific for result type
Name of the periodical
Wiley Interdisciplinary Reviews-Data Mining and Knowledge Discovery
ISSN
1942-4787
e-ISSN
1942-4795
Volume of the periodical
14
Issue of the periodical within the volume
6
Country of publishing house
US - UNITED STATES
Number of pages
36
Pages from-to
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UT code for WoS article
001268637600001
EID of the result in the Scopus database
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