TY - JOUR AU - Günther, Stefan AU - Senger, Christian AU - Michalsky, Elke AU - Goede, Andrean AU - Preissner, Robert PY - 2006 DA - 2006/06/09 TI - Representation of target-bound drugs by computed conformers: implications for conformational libraries JO - BMC Bioinformatics SP - 293 VL - 7 IS - 1 AB - The increasing number of known protein structures provides valuable information about pharmaceutical targets. Drug binding sites are identifiable and suitable lead compounds can be proposed. The flexibility of ligands is a critical point for the selection of potential drugs. Since computed 3D structures of millions of compounds are available, the knowledge of their binding conformations would be a great benefit for the development of efficient screening methods. SN - 1471-2105 UR - https://doi.org/10.1186/1471-2105-7-293 DO - 10.1186/1471-2105-7-293 ID - Günther2006 ER -