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|| Patterson and molecular replacement techniques, and the use of noncrystallographic symmetry in phasing

✍ Scribed by Tong, L.

Book ID
120056049
Publisher
International Union of Crystallography
Year
2010
Weight
816 KB
Category
Article

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πŸ“œ SIMILAR VOLUMES

A new rotation function for molecular re
A new rotation function for molecular replacement by using both the self and cross Patterson vectors
✍ Jiang, Fan πŸ“‚ Article πŸ“… 2008 πŸ› International Union of Crystallography 🌐 English βš– 163 KB

The rotation function in molecular replacement is traditionally computed in reciprocal space. The common practice is to use a Patterson vector radius of about the size of the target molecule to limit the interatomic vectors to match only the Patterson self-vectors. In real space, the molecular image

On the combination of molecular replacem
On the combination of molecular replacement and single-wavelength anomalous diffraction phasing for automated structure determination
✍ Panjikar, Santosh ;Parthasarathy, Venkataraman ;Lamzin, Victor S. ;Weiss, Manfre πŸ“‚ Article πŸ“… 2009 πŸ› International Union of Crystallography 🌐 English βš– 756 KB

A combination of molecular replacement and single-wavelength anomalous diffraction phasing has been incorporated into the automated structure-determination platform Auto-Rickshaw. The complete MRSAD procedure includes molecular replacement, model refinement, experimental phasing, phase improvement a

Use of molecular symmetry in SCF calcula
Use of molecular symmetry in SCF calculations
✍ M. Elder πŸ“‚ Article πŸ“… 1973 πŸ› John Wiley and Sons 🌐 English βš– 550 KB

## Abstract A method is described whereby molecular symmetry properties may be used to reduce the numbers of one‐ and two‐electron integrals that need to be calculated and stored in the course of a molecular SCF calculation. The method is a generalization of a previously reported procedure, extendi