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Figure 3
Workflows relevant for structure-based drug design. (a) Use of structure during the phases of a drug discovery project. (b) Workflow for iterative crystallography linked to the DMTA cycle. The ideal iterative crystallography workflow starts with compound introduction on a Monday followed by crystal harvesting and sample shipment on Tuesday. On Thursday data are collected, and on Friday the data can be retrieved and the structure solved. The structure then feeds into the design phase of the DMTA cycle. |