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ABSTRACT:
SUBMITTER: Kurczynska M
PROVIDER: S-EPMC4842210 | biostudies-literature | 2016 May
REPOSITORIES: biostudies-literature
Kurczynska Monika M Kania Ewa E Konopka Bogumil M BM Kotulska Malgorzata M
Journal of molecular modeling 20160423 5
Reconstructing protein structure based on contact maps leads to two types of models: properly oriented models and mirror models. This is due to the fact that contact maps do not include information on protein chirality. Therefore, both types of model orientations share the same contact map and are geometrically allowed. In this work, we verified the hypothesis that some of the energy terms calculated by PyRosetta could be useful to distinguish between properly oriented and mirror models. We stud ...[more]