Preventing lipophilic aggregation in cosolvent molecular dynamics simulations with hydrophobic probes using Plumed Automatic Restraining Tool (PART)
Source
Journal of Cheminformatics - ISSN 1758-2946-16:1 (2024) p. 1-11
Biophysical characterization of the Plasmodium falciparum circumsporozoite protein's N‐terminal domain
Source
Protein science - ISSN 0961-8368-31:1 (2024) p. 1-17
Highly selective inhibitors of dipeptidyl peptidase 9 (DPP9) derived from the clinically used DPP4-inhibitor vildagliptin
Source
Journal of medicinal chemistry - ISSN 1520-4804-66:18 (2023) p. 12717-12738
Vildagliptin‐derived dipeptidyl peptidase 9 (DPP9) inhibitors : identification of a DPP8/9‐specific lead
Source
ChemMedChem - ISSN 1860-7179-17:15 (2022) p. 1-16