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Discovery of compound candidates for the treatment of allergic diseases: integration of DFT analyses, molecular docking, molecular dynamics simulations, and ADMET profiling

Crossref DOI link: https://doi.org/10.1186/s40360-026-01104-4

Published Online: 2026-03-04

Update policy: https://doi.org/10.1007/springer_crossmark_policy

Authors

Unsal, Velid https://orcid.org/0000-0003-1415-0563
Oner, Erkan

Yıldız, Reşit

Saha, Supriyo

Mert, Başak Doğru

Aksan, Mehmet Emrah

Hatipoğlu, Abdulkerim
License Information

Text and Data Mining valid from 2026-03-04

Accepted Manuscript valid from 2026-03-04
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Article History

Received: 21 November 2025

Accepted: 6 February 2026

First Online: 4 March 2026

Declarations

:

: This research does not require ethical approval or Not applicable. The study did not include any human or animal participants that required consent to participate and/or publish findings.

: All authors have approved the article and declared that it is an original contribution and that no material in this article has been considered for publication elsewhere.

: The authors declare no competing interests.

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