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ensemble-based analyses - acPSN #24

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elenapapaleo opened this issue Oct 2, 2022 · 1 comment

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current toolkit enhancement

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elenapapaleo commented Oct 2, 2022

to implement the workflow for:

changes in Interaction Strengths (both for stability (intra) and local-interaction (inter)
decision tree for hub and stability
changes in the paths of interaction (for long-range module)
changes in hydrogen-bonds networks and salt bridges (intra for stability) and inter for local-interactions

elenapapaleo added the current toolkit enhancement label

elenapapaleo assigned elenapapaleo and kar0liina

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elenapapaleo commented Nov 1, 2024

path-based approach included in ensemble mode
decision tree for hubs ongoing

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