Combining structure-based drug design and pharmacophores
نویسندگان
چکیده
منابع مشابه
Combining structure-based drug design and pharmacophores.
Development towards integrated computer-aided drug design methodologies is presented by utilising crystal structure complexes to produce structure-based pharmacophores. These novel pharmacophores represent the ligand features that are involved in interactions with the target protein, as well as the space around the ligand occupied by the protein. The protein-ligand complexes can also yield info...
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ژورنال
عنوان ژورنال: Journal of Molecular Graphics and Modelling
سال: 2005
ISSN: 1093-3263
DOI: 10.1016/j.jmgm.2004.12.001