Molecular replacement with MOLREP.
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.
Vagin
Alexei
A
Structural Biology Laboratory, University of York, Heslington, York YO10 5YW, England. alexei@ysbl.york.ac.uk
Teplyakov
Alexei
A
D003460:Crystallization; D018360:Crystallography, X-Ray / Q000379:methods*; D001330:Electronic Data Processing; D008956:Models, Chemical; D008968:Molecular Conformation; D057386:Search Engine; D012984:Software