Abstract | ||
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We have recently introduced GMA, a highly efficient method for flexible molecular alignment. Here we show how this approach can be used to improve docking accuracy and efficiency, in cases where a complex structure of a ligand with the target protein is known. In cases where a known ligand exists, yet the complex structure is unknown it is possible to make use of the advantages offered by this approach, by combining it with standard ligand docking. |
Year | DOI | Venue |
---|---|---|
2008 | 10.1021/ci700124r | JOURNAL OF CHEMICAL INFORMATION AND MODELING |
Field | DocType | Volume |
Lead Finder,Docking (dog),Searching the conformational space for docking,Ligand,Protein–ligand docking,Combinatorial chemistry,Target protein,Chemistry,Bioinformatics | Journal | 48 |
Issue | ISSN | Citations |
1 | 1549-9596 | 0 |
PageRank | References | Authors |
0.34 | 0 | 3 |
Name | Order | Citations | PageRank |
---|---|---|---|
J Marialke | 1 | 3 | 0.75 |
S Tietze | 2 | 3 | 0.75 |
Joannis Apostolakis | 3 | 112 | 9.64 |