A. Costache

AmineDB: Large scale docking of amines with CYP2D6 and scoring for druglike properties—towards defining the scope of the chemical defense against foreign amines in humans

A. Costache, D. Trawick, D. Bohl, 2007, Xenobiotica; the fate of foreign compounds in biological systems.

Percutaneous penetration modifiers and formulation effects.

A. Costache, D. Kaushik, B. Michniak-Kohn, 2010, International journal of pharmaceutics.

Structural evidence for a functionally relevant second camphor binding site in P450cam: Model for substrate entry into a P450 active site

A. Costache, D. Sem, H. Yao, 2007, Proteins.

Homology-Modeled Ligand-Binding Domains of Zebrafish Estrogen Receptors α, β1, and β2: From in Silico to in Vivo Studies of Estrogen Interactions in Danio rerio as a Model System

A. Costache, D. Sem, P. K. Pullela, 2005 .

Systems-based design of bi-ligand inhibitors of oxidoreductases: filling the chemical proteomic toolbox.

Maurizio Pellecchia, Daniel S Sem, H. Villar, 2004, Chemistry & biology.

Polymer-drug interactions in tyrosine-derived triblock copolymer nanospheres: a computational modeling approach.

Joachim Kohn, A. Costache, D. Knight, 2009, Molecular pharmaceutics.

Chemical Proteomic Tool for Ligand Mapping of CYP Antitargets: An NMR-Compatible 3D QSAR Descriptor in the Heme-Based Coordinate System

Huili Yao, Aurora D. Costache, Daniel S. Sem, 2004, J. Chem. Inf. Model..