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Computational Approaches for Antimicrobial Peptide Delivery

Rios, Thuanny Borba ; Rezende, Samilla Beatriz ; Maximiano, Mariana Rocha ; Cardoso, Marlon Henrique ; Malmsten, Martin LU ; de la Fuente-Nunez, Cesar and Franco, Octávio Luiz LU (2024) In Bioconjugate Chemistry 35(12). p.1873-1882
Abstract

Peptides constitute alternative molecules for the treatment of infections caused by bacteria, viruses, fungi, and protozoa. However, their therapeutic effectiveness is often limited by enzymatic degradation, chemical and physical instability, and toxicity toward healthy human cells. To improve their pharmacokinetic (PK) and pharmacodynamic (PD) profiles, novel routes of administration are being explored. Among these, nanoparticles have shown promise as potential carriers for peptides, although the design of delivery vehicles remains a slow and painstaking process, heavily reliant on trial and error. Recently, computational approaches have been introduced to accelerate the development of effective drug delivery systems for peptides. Here... (More)

Peptides constitute alternative molecules for the treatment of infections caused by bacteria, viruses, fungi, and protozoa. However, their therapeutic effectiveness is often limited by enzymatic degradation, chemical and physical instability, and toxicity toward healthy human cells. To improve their pharmacokinetic (PK) and pharmacodynamic (PD) profiles, novel routes of administration are being explored. Among these, nanoparticles have shown promise as potential carriers for peptides, although the design of delivery vehicles remains a slow and painstaking process, heavily reliant on trial and error. Recently, computational approaches have been introduced to accelerate the development of effective drug delivery systems for peptides. Here we present an overview of some of these computational strategies and discuss their potential to optimize drug development and delivery.

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author
; ; ; ; ; and
organization
publishing date
type
Contribution to journal
publication status
published
subject
in
Bioconjugate Chemistry
volume
35
issue
12
pages
10 pages
publisher
The American Chemical Society (ACS)
external identifiers
  • scopus:85209549651
  • pmid:39541149
ISSN
1043-1802
DOI
10.1021/acs.bioconjchem.4c00406
language
English
LU publication?
yes
id
a6bd9a21-6111-4f31-9b74-0a80031e1ac8
date added to LUP
2025-02-04 14:29:17
date last changed
2025-07-09 03:07:10
@article{a6bd9a21-6111-4f31-9b74-0a80031e1ac8,
  abstract     = {{<p>Peptides constitute alternative molecules for the treatment of infections caused by bacteria, viruses, fungi, and protozoa. However, their therapeutic effectiveness is often limited by enzymatic degradation, chemical and physical instability, and toxicity toward healthy human cells. To improve their pharmacokinetic (PK) and pharmacodynamic (PD) profiles, novel routes of administration are being explored. Among these, nanoparticles have shown promise as potential carriers for peptides, although the design of delivery vehicles remains a slow and painstaking process, heavily reliant on trial and error. Recently, computational approaches have been introduced to accelerate the development of effective drug delivery systems for peptides. Here we present an overview of some of these computational strategies and discuss their potential to optimize drug development and delivery.</p>}},
  author       = {{Rios, Thuanny Borba and Rezende, Samilla Beatriz and Maximiano, Mariana Rocha and Cardoso, Marlon Henrique and Malmsten, Martin and de la Fuente-Nunez, Cesar and Franco, Octávio Luiz}},
  issn         = {{1043-1802}},
  language     = {{eng}},
  number       = {{12}},
  pages        = {{1873--1882}},
  publisher    = {{The American Chemical Society (ACS)}},
  series       = {{Bioconjugate Chemistry}},
  title        = {{Computational Approaches for Antimicrobial Peptide Delivery}},
  url          = {{http://dx.doi.org/10.1021/acs.bioconjchem.4c00406}},
  doi          = {{10.1021/acs.bioconjchem.4c00406}},
  volume       = {{35}},
  year         = {{2024}},
}