Blind protein structure prediction using accelerated free-energy simulations
نویسندگان
چکیده
We report a key proof of principle of a new acceleration method [Modeling Employing Limited Data (MELD)] for predicting protein structures by molecular dynamics simulation. It shows that such Boltzmann-satisfying techniques are now sufficiently fast and accurate to predict native protein structures in a limited test within the Critical Assessment of Structure Prediction (CASP) community-wide blind competition.
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عنوان ژورنال:
دوره 2 شماره
صفحات -
تاریخ انتشار 2016