970 Million Druglike Small Molecules for Virtual Screening in the Chemical Universe Database GDB-13

publication · 9 years ago
by Lorenz Blum, Jean-Louis Reymond (University of Berne)
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GDB-13 enumerates small organic molecules containing up to 13 atoms of C, N, O, S, and Cl following simple chemical stability and synthetic feasibility rules. With 977 468 314 structures, GDB-13 is the largest publicly available small organic molecule database to date.
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