A computer-aided approach to identify novel Leishmania major protein disulfide isomerase inhibitors for treatment of leishmaniasis. - Ben Khalaf, Noureddine; Pham, Susie; Romeo, Giuseppe; Abdelghany, Sara; Intagliata, Sebastiano; Sedillo, Peter; Salerno, Loredana; Gonzales, Jessica; Fathallah, Dahmani M.; Perkins, Douglas J.; Hurwitz, Ivy; Pittalà, Valeria (Journal of Computer-Aided Molecular Design, 2021)