Title: Application of a simple quantum chemical approach to ligand fragment scoring for Trypanosoma brucei pteridine reductase 1 inhibition
Authors: Wiktoria Jedwabny, Joanna Panecka-Hofman, Edyta Dyguda-Kazimierowicz, Rebecca C. Wade, W. Andrzej Sokalski
Journal: Journal of Computer-Aided Molecular Design
Publication type: article
DOI: 10.1007/s10822-017-0035-4