Average block selection using relaxation data
This protocol is extracted from research article:
Solvent-dependent segmental dynamics in intrinsically disordered proteins
Sci Adv, Jun 28, 2019; DOI: 10.1126/sciadv.aax2348

To minimize force field–dependent inaccuracies, we applied our ABSURD procedure as described in (28, 30). Tentatively, we performed the selection for each simulation using each spin relaxation dataset recorded at the simulated temperature. Then, we considered only the selection that yields the lowest global χ2 value, calculated comparing the selected trajectory segments with all the relaxation rates measured at that temperature. The results of this procedure are summarized in table S2.

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