Yiqun Cao

Automated Docking Screens: A Feasibility Study

Michael M. Mysinger, J. Irwin, B. Shoichet, 2009, Journal of medicinal chemistry.

ChemmineR: A Compound Mining Toolkit for Chemical Genomics in R

T. Girke, Yiqun Cao, A. Charisi, 2009 .

A maximum common substructure-based algorithm for searching and predicting drug-like compounds

Tao Jiang, Yiqun Cao, Thomas Girke, 2008, ISMB.

ChemMine tools: an online service for analyzing and clustering small molecules

Yiqun Cao, Thomas Girke, Tyler W. H. Backman, 2011, Nucleic Acids Res..

ChemmineR: a compound mining framework for R

Tao Jiang, Yiqun Cao, Thomas Girke, 2008, Bioinform..

Novel Structure Similarity-Based Methods for Identifying Drug-Like Compounds

Yiqun Cao, Yiqun Cao, 2010 .

Accelerated similarity searching and clustering of large compound sets by geometric embedding and locality sensitive hashing

Tao Jiang, Yiqun Cao, Thomas Girke, 2010, Bioinform..