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In-silico screening, pharmacokinetic evaluation, DFT study, and molecular dynamic simulation as approaches for the identification of acetamide and acetic acid derivatives as potential antisickling agents targeting Hba protein

Crossref DOI link: https://doi.org/10.1007/s44371-025-00136-9

Published Online: 2025-03-23

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

Authors

Ejeh, Stephen https://orcid.org/0000-0002-3065-6575
Ajala, Abduljelil https://orcid.org/0000-0002-9823-8847
Adawara, Samuel Ndaghiya https://orcid.org/0000-0002-8789-7871
Babatunde, Olasupo Sabitu https://orcid.org/0000-0003-1946-7404
Ibrahim, Zakari Ya’u https://orcid.org/0000-0002-5081-2600
Abdulfatai, Usman https://orcid.org/0000-0003-4397-8423
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Text and Data Mining valid from 2025-03-23

Version of Record valid from 2025-03-23
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Article History

Received: 4 October 2024

Accepted: 17 March 2025

First Online: 23 March 2025

Declarations

:

: Not applicable.

: Not applicable.

: On behalf of all authors, the corresponding author states that there is no conflict of interest.

: Not applicable.

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