Modeling water molecules in protein-ligand docking using GOLD.
Verdonk ML, Chessari G, Cole JC, Hartshorn MJ, Murray CW, Nissink JW, Taylor RD, Taylor R, J Med Chem, 2005 Oct 6 - link
Comparing protein-ligand docking programs is difficult.
Cole JC, Murray CW, Nissink JW, Taylor RD, Taylor R, Proteins, 2005 Aug 15 - link
Virtual screening using protein-ligand docking: avoiding artificial enrichment.
Verdonk ML, Berdini V, Hartshorn MJ, Mooij WT, Murray CW, Taylor RD, Watson P, J Chem Inf Comput Sci, 2004 May-Jun - link
FDS: flexible ligand and receptor docking with a continuum solvent model and soft-core energy function.
Taylor RD, Jewsbury PJ, Essex JW, J Comput Chem, 2003 Oct - link
Improved protein-ligand docking using GOLD.
Verdonk ML, Cole JC, Hartshorn MJ, Murray CW, Taylor RD, Proteins, 2003 Sep 1 - link
A review of protein-small molecule docking methods.
Taylor RD, Jewsbury PJ, Essex JW, J Comput Aided Mol Des, 2002 Mar - link