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- W2321801197 abstract "Every year, several million compounds for drug screening are released by numerous vendors around the world. The information provided on these compounds is in the form of their two-dimensional (2D) structures. We have developed a software system to generate a database of three-dimensional (3D) structures of these compounds and have distributed this database. We have also developed a database of protein-compound docking scores of 180 proteins with respect to these millions of compounds. These databases make it possible to identify new active compounds for many drug targets." @default.
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- W2321801197 date "2009-01-01" @default.
- W2321801197 modified "2023-09-25" @default.
- W2321801197 title "Advanced in-silico drug screening to achieve high hit ratio" @default.
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- W2321801197 doi "https://doi.org/10.5571/syntheng.2.64" @default.
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