Molecular docking, density functional theory, and molecular dynamics study of pipecolisporin derivatives: Unveiling the antimalarial potential of novel cyclic peptides


	The two-dimensional and three-dimensional depictions illustrate the hydrogen bonds and hydrophobic interactions between the ligands and the binding cavities of the receptors.

Part of: Kurniaty N, Fakih TM, Maharani R, Supratman U, Hidayat AT (2025) Molecular docking, density functional theory, and molecular dynamics study of pipecolisporin derivatives: Unveiling the antimalarial potential of novel cyclic peptides. Pharmacia 72: 1-21. https://doi.org/10.3897/pharmacia.72.e142361