Iwona E. Weidlich

PDB Ligand Conformational Energies Calculated Quantum-Mechanically

Markus Sitzmann, Iwona E. Weidlich, Igor Filippov et al. · Journal of Chemical Information and Modeling · 2012 · 63 citations · Full text

Ligand Expo Database, Engineering, Conformational Energies +13

4-Pregnen-21-ol-3,20-dione-21-(4-bromobenzenesufonate) (NSC 88915) and Related Novel Steroid Derivatives as Tyrosyl-DNA Phosphodiesterase (Tdp1) Inhibitors

Thomas S. Dexheimer, Lalji K. Gediya, Andrew G. Stephen et al. · Journal of Medicinal Chemistry · 2009 · 52 citations · Full text

Inhibitors of human tyrosyl-DNA phospodiesterase (hTdp1) developed by virtual screening using ligand-based pharmacophores

Iwona E. Weidlich, Thomas S. Dexheimer, Christophe Marchand et al. · Bioorganic & Medicinal Chemistry · 2009 · 28 citations · Full text

Ligand-based Pharmacophores, Medicinal Chemistry, Drug Target +9

Inhibitors for the hepatitis C virus RNA polymerase explored by SAR with advanced machine learning methods

Iwona E. Weidlich, Igor Filippov, Jodian A. Brown et al. · Bioorganic & Medicinal Chemistry · 2013 · 25 citations · Full text

Engineering, Computational Medicine, Computational Biology +12

Using the gini coefficient to measure the chemical diversity of small‐molecule libraries

Iwona E. Weidlich, Igor Filippov · Journal of Computational Chemistry · 2016 · 19 citations