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Chemical Space for Antimicrobials on a Peptide Basis

Publications

Machine learning designs non-hemolytic antimicrobial peptides

Author(s): Alice Capecchi; Xingguang Cai; Hippolyte Personne; Thilo Köhler; Christian van Delden; Jean-Louis Reymond
Published in: Chemical Science, 12(26), 2021, Page(s) 9221-9232, ISSN 2041-6539
Publisher: Royal Society of Chemistry
DOI: 10.1039/d1sc01713f

A mixed chirality α-helix in a stapled bicyclic and a linear antimicrobial peptide revealed by X-ray crystallography

Author(s): Stéphane Baeriswyl; Hippolyte Personne; Ivan Di Bonaventura; Thilo Köhler; Christian van Delden; Achim Stocker; Sacha Javor; Jean-Louis Reymond
Published in: RSC chemical biology, 2(6), 2021, Page(s) 1608-1617, ISSN 2633-0679
Publisher: Royal Society of Chemistry
DOI: 10.1039/d1cb00124h

Machine Learning Guided Discovery of Non-Hemolytic Membrane Disruptive Anticancer Peptides

Author(s): E. Zakharova, Markus Orsi, A. Capecchi, J.-L. Reymond
Published in: ChemMedChem, 2022, ISSN 1860-7187
Publisher: Wiley
DOI: 10.1002/cmdc.202200291

Classifying Natural Products from Plants, Fungi or Bacteria using the COCONUT Database and Machine Learning

Author(s): Alice Capecchi; Jean-Louis Reymond
Published in: Journal of cheminformatics, 13(82), 2021, Page(s) 1069, ISSN 1758-2946
Publisher: Chemistry Central
DOI: 10.26434/chemrxiv-2021-gxjgc-v2

The antibacterial activity of peptide dendrimers and polymyxin B increases sharply above pH 7.4

Author(s): Xingguang Cai; Sacha Javor; Bee Ha Gan; Thilo Köhler; Jean-Louis Reymond
Published in: Chemical communications, 57(46), 2021, Page(s) 5654-5657, ISSN 1359-7345
Publisher: Royal Society of Chemistry
DOI: 10.1039/d1cc01838h

Datasets

Dataset for: The antibacterial activity of peptide dendrimers and polymyxin B increases sharply above pH 7.4

Author(s): Xingguang Cai; Javor, Sacha; Gan, Bee Ha; Köhler, Thilo; Reymond, Jean-Louis
Published in: Zenodo

Machine learning designs non-hemolytic antimicrobial peptides

Author(s): Capecchi, Alice; Cai, Xingguang; Hippolyte Personne,; Kohler, Thilo; Van Delden, Christian; Reymond, Jean-Louis
Published in: Zenodo