Molecular replacement with MOLREP

作者:Vagin Alexei*; Teplyakov Alexei
来源:Acta Crystallographica Section D-Biological Crystallography, 2010, 66(1): 22-25.
DOI:10.1107/S0907444909042589

摘要

MOLREP is an automated program for molecular replacement that utilizes a number of original approaches to rotational and translational search and data preparation. Since the first publication describing the program, MOLREP has acquired a variety of features that include weighting of the X-ray data and search models, multi-copy search, fitting the model into electron density, structural superposition of two models and rigid-body refinement. The program can run in a fully automatic mode using optimized parameters calculated from the input data.

  • 出版日期2010-1