Virtual Screening | Chemogenomics Structural Group

Comparative evaluation of eight docking tools for docking and virtual screening accuracy

Eight docking programs (DOCK, FLEXX, FRED, GLIDE, GOLD, SLIDE, SURFLEX, and QXP) that can be used for either single-ligand docking or database screening have been compared for …

Kellenberger, E.

• Jan 1, 2004 • 1 min read

ConsDock: A new program for the consensus analysis of protein–ligand interactions

Protein-based virtual screening of chemical libraries is a powerful technique for identifying new molecules that may interact with a macromolecular target of interest.

Paul, N.

• Jan 1, 2002 • 1 min read

Synergistic Use of Virtual Screening and Biophysical Methods for the Protein-Based Design of Peptidomimetics

Combining virtual screening with biophysical studies of protein-ligand complexes is an effective tool for designing new peptidomimetics.

Rognan, D.

• Nov 1, 2000 • 1 min read