Special Issue: "Rational Design and Synthesis of Bioactive Molecules"

doi:10.3390/ijms25189927

Editorial

. 2024 Sep 14;25(18):9927.

doi: 10.3390/ijms25189927.

Special Issue: "Rational Design and Synthesis of Bioactive Molecules"

Irena Kostova¹

Affiliations

PMID: 39337415
PMCID: PMC11432531
DOI: 10.3390/ijms25189927

Editorial

Special Issue: "Rational Design and Synthesis of Bioactive Molecules"

Irena Kostova. Int J Mol Sci. 2024.

. 2024 Sep 14;25(18):9927.

doi: 10.3390/ijms25189927.

Author

Irena Kostova¹

Affiliation

¹ Department of Chemistry, Faculty of Pharmacy, Medical University, 2 Dunav St., 1000 Sofia, Bulgaria.

PMID: 39337415
PMCID: PMC11432531
DOI: 10.3390/ijms25189927

Abstract

The rational design of novel bioactive molecules is a critical but challenging task in drug discovery [...].

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Conflict of interest statement

The author declares no conflicts of interest.

Cited by

Molecular structural arrangement in quorum sensing and bacterial metabolic production.
Chigozie VU, Saki M, Esimone CO. Chigozie VU, et al. World J Microbiol Biotechnol. 2025 Feb 13;41(2):71. doi: 10.1007/s11274-025-04280-3. World J Microbiol Biotechnol. 2025. PMID: 39939401 Review.

References

1. Li X., Li X., Liu F., Li S., Shi D. Rational multitargeted drug design strategy from the perspective of a medicinal chemist. J. Med. Chem. 2021;64:10581–10605. doi: 10.1021/acs.jmedchem.1c00683. - DOI - PubMed
1. Xu C., Hong Y. Rational design of biodegradable thermoplastic polyurethanes for tissue repair. Bioact. Mater. 2022;15:250–271. doi: 10.1016/j.bioactmat.2021.11.029. - DOI - PMC - PubMed
1. Yang Y., Ren Y., Song W., Yu B., Liu H. Rational design in functional hydrogels towards biotherapeutics. Mater. Des. 2022;223:111086. doi: 10.1016/j.matdes.2022.111086. - DOI
1. Chen Z., Yu Y., Gao Y., Zhu Z. Rational design strategies for nanozymes. ACS Nano. 2023;17:13062–13080. doi: 10.1021/acsnano.3c04378. - DOI - PubMed
1. Zhu H., Zhou R., Cao D., Tang J., Li M. A pharmacophore-guided deep learning approach for bioactive molecular generation. Nat. Commun. 2023;14:6234. doi: 10.1038/s41467-023-41454-9. - DOI - PMC - PubMed

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[1] Li X., Li X., Liu F., Li S., Shi D. Rational multitargeted drug design strategy from the perspective of a medicinal chemist. J. Med. Chem. 2021;64:10581–10605. doi: 10.1021/acs.jmedchem.1c00683. - DOI - PubMed

[2] Li X., Li X., Liu F., Li S., Shi D. Rational multitargeted drug design strategy from the perspective of a medicinal chemist. J. Med. Chem. 2021;64:10581–10605. doi: 10.1021/acs.jmedchem.1c00683. - DOI - PubMed

[3] Xu C., Hong Y. Rational design of biodegradable thermoplastic polyurethanes for tissue repair. Bioact. Mater. 2022;15:250–271. doi: 10.1016/j.bioactmat.2021.11.029. - DOI - PMC - PubMed

[4] Xu C., Hong Y. Rational design of biodegradable thermoplastic polyurethanes for tissue repair. Bioact. Mater. 2022;15:250–271. doi: 10.1016/j.bioactmat.2021.11.029. - DOI - PMC - PubMed

[5] Yang Y., Ren Y., Song W., Yu B., Liu H. Rational design in functional hydrogels towards biotherapeutics. Mater. Des. 2022;223:111086. doi: 10.1016/j.matdes.2022.111086. - DOI

[6] Yang Y., Ren Y., Song W., Yu B., Liu H. Rational design in functional hydrogels towards biotherapeutics. Mater. Des. 2022;223:111086. doi: 10.1016/j.matdes.2022.111086. - DOI

[7] Chen Z., Yu Y., Gao Y., Zhu Z. Rational design strategies for nanozymes. ACS Nano. 2023;17:13062–13080. doi: 10.1021/acsnano.3c04378. - DOI - PubMed

[8] Chen Z., Yu Y., Gao Y., Zhu Z. Rational design strategies for nanozymes. ACS Nano. 2023;17:13062–13080. doi: 10.1021/acsnano.3c04378. - DOI - PubMed

[9] Zhu H., Zhou R., Cao D., Tang J., Li M. A pharmacophore-guided deep learning approach for bioactive molecular generation. Nat. Commun. 2023;14:6234. doi: 10.1038/s41467-023-41454-9. - DOI - PMC - PubMed

[10] Zhu H., Zhou R., Cao D., Tang J., Li M. A pharmacophore-guided deep learning approach for bioactive molecular generation. Nat. Commun. 2023;14:6234. doi: 10.1038/s41467-023-41454-9. - DOI - PMC - PubMed

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Special Issue: "Rational Design and Synthesis of Bioactive Molecules"

Affiliation

Special Issue: "Rational Design and Synthesis of Bioactive Molecules"

Author

Affiliation

Abstract

Conflict of interest statement

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