Marcel L. Verdonk

Improved protein–ligand docking using GOLD

Marcel L. Verdonk, Jason C. Cole, Michael J. Hartshorn et al. · Proteins Structure Function and Bioinformatics · 2003 · 3K citations · Full text

Diverse, High-Quality Test Set for the Validation of Protein−Ligand Docking Performance

Michael J. Hartshorn, Marcel L. Verdonk, Gianni Chessari et al. · Journal of Medicinal Chemistry · 2007 · 628 citations

A new test set for validating predictions of protein–ligand interaction

J. Willem M. Nissink, Christopher W. Murray, Mike Hartshorn et al. · Proteins Structure Function and Bioinformatics · 2002 · 428 citations

Modeling Water Molecules in Protein−Ligand Docking Using GOLD

Marcel L. Verdonk, Gianni Chessari, Jason C. Cole et al. · Journal of Medicinal Chemistry · 2005 · 386 citations

Protein Chemistry, Biochemistry, Water Mediation +13

Virtual Screening Using Protein−Ligand Docking:  Avoiding Artificial Enrichment

Marcel L. Verdonk, Valério Berdini, Michael J. Hartshorn et al. · Journal of Chemical Information and Computer Sciences · 2004 · 376 citations

Virtual Screening, Engineering, Hit Identification +14