DOVIS 2.0: an efficient and easy to use parallel virtual screening tool based on AutoDock 4.0
نویسندگان
چکیده
منابع مشابه
DOVIS 2.0: an efficient and easy to use parallel virtual screening tool based on AutoDock 4.0
BACKGROUND Small-molecule docking is an important tool in studying receptor-ligand interactions and in identifying potential drug candidates. Previously, we developed a software tool (DOVIS) to perform large-scale virtual screening of small molecules in parallel on Linux clusters, using AutoDock 3.05 as the docking engine. DOVIS enables the seamless screening of millions of compounds on high-pe...
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ژورنال
عنوان ژورنال: Chemistry Central Journal
سال: 2008
ISSN: 1752-153X
DOI: 10.1186/1752-153x-2-18