Generalized–ensemble method study: A helix‐mimetic compound inhibits protein–protein interaction by long‐range and short‐range intermolecular interactions
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DOI: 10.1002/jcc.26516
Abstract: A heterocyclic compound mS‐11 is a helix‐mimetic designed to inhibit binding of an intrinsic disordered protein neural restrictive silence factor/repressor element 1 silencing factor (NRSF/REST) to a receptor protein mSin3B. We apply a generalized ensemble… read more here.
Keywords: nrsf rest; ensemble method; range; helix mimetic ... See more keywords