Computer-Aided Design of Peptidomimetic Inhibitors of Falcipain-3: QSAR and Pharmacophore Models

• Main Authors: Boris D. Bekono (Author), Akori E. Esmel (Author), Brice Dali (Author), Fidele Ntie-Kang (Author), Melalie Keita (Author), Luc C. O. Owono (Author), Eugene Megnassan (Author)
• Format: Book
• Published: MDPI AG, 2021-09-01T00:00:00Z.
• Subjects: article
• Online Access: Connect to this object online.

In this work, antiparasitic peptidomimetics inhibitors (PEP) of falcipain-3 (FP3) of <i>Plasmodium falciparum</i> (<i>Pf</i>) are proposed using structure-based and computer-aided molecular design. Beginning with the crystal structure of <i>Pf</i>FP3-K11017 comple...