PubChem3D: Biologically relevant 3-D similarity

Design of Multitarget Activity Landscapes That Capture Hierarchical Activity Cliff Distributions

(2011) Dilyana Dimova et al.   Journal of Chemical Information and Modeling

Chemical Substitutions That Introduce Activity Cliffs Across Different Compound Classes and Biological Targets

(2010) Anne Mai Wassermann et al.   Journal of Chemical Information and Modeling

Molecular Shape and Medicinal Chemistry: A Perspective

(2010) Anthony Nicholls et al.   JOURNAL OF MEDICINAL CHEMISTRY

Characterization of Activity Landscapes Using 2D and 3D Similarity Methods:Consensus Activity Cliffs

(2009) Jose L. Medina-Franco et al.   Journal of Chemical Information and Modeling

Combinatorial chemistry: oh what a decade or two can do

(2009) Walter H. Moos et al.   MOLECULAR DIVERSITY

An overview of the PubChem BioAssay resource

(2009) Yanli Wang et al.   NUCLEIC ACIDS RESEARCH

Database resources of the National Center for Biotechnology Information

(2009) Eric W. Sayers et al.   NUCLEIC ACIDS RESEARCH

PubChem: a public information system for analyzing bioactivities of small molecules

(2009) Y. Wang et al.   NUCLEIC ACIDS RESEARCH

High-throughput electrophysiology: an emerging paradigm for ion-channel screening and physiology

(2008) John Dunlop et al.   NATURE REVIEWS DRUG DISCOVERY