Nature 2020 01 30 Part.02

(Grace) #1

Article


Extended Data Fig. 4 | TM score versus per-target computation time
computed as an average over the test set. Structure realization requires a
modest computation budget, which can be parallelized over multiple
machines. Full optimization with noisy restarts (orange) is compared with
initialization from sampled torsions (blue). Computation is measured as the


product of the number of (CPU-based) machines and time elapsed and can be
largely parallelized. Longer targets take longer to optimize. Figure 2e shows
how the TM score increases with the number of repeats of gradient descent.
n = 37 7.
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