SUPERFLIP: charge flipping
Sheldrick, G. M.,
Gilmore, C. J.,
Hauptman, H. A.,
Weeks, C. M.,
Miller, R. and
Usón, I.,
International Tables for Crystallography
(2012).
Vol. F,
Section 16.1.12.6,
pp. 428-429
[ doi:10.1107/97809553602060000850 ]
[
more
results from section 16.1.12 in volume F]
Data completeness
Sheldrick, G. M.,
Gilmore, C. J.,
Hauptman, H. A.,
Weeks, C. M.,
Miller, R. and
Usón, I.,
International Tables for Crystallography
(2012).
Vol. F,
Section 16.1.1.2,
pp. 414-414
[ doi:10.1107/97809553602060000850 ]
[
more
results from section 16.1.1 in volume F]
Resolution enhancement: the `free lunch' algorithm
Sheldrick, G. M.,
Gilmore, C. J.,
Hauptman, H. A.,
Weeks, C. M.,
Miller, R. and
Usón, I.,
International Tables for Crystallography
(2012).
Vol. F,
Section 16.1.7,
pp. 419-419
[ doi:10.1107/97809553602060000850 ]
method towards structure solution from incomplete data sets . J. Appl. Cryst. 40, 456–462. Google Scholar
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G.
M. (2007). Structure determination of the O-methyltransferase NovP ...
Random omit maps
Sheldrick, G. M.,
Gilmore, C. J.,
Hauptman, H. A.,
Weeks, C. M.,
Miller, R. and
Usón, I.,
International Tables for Crystallography
(2012).
Vol. F,
Section 16.1.5.3,
pp. 419-419
[ doi:10.1107/97809553602060000850 ]
[
more
results from section 16.1.5 in volume F]
SAD differences
Sheldrick, G. M.,
Gilmore, C. J.,
Hauptman, H. A.,
Weeks, C. M.,
Miller, R. and
Usón, I.,
International Tables for Crystallography
(2012).
Vol. F,
Section 16.1.2.2,
pp. 416-416
[ doi:10.1107/97809553602060000850 ]
and the corresponding | E A | values are derived by SHELXD .
References
Sheldrick,
G.
M. (2008). A short history of SHELX . Acta Cryst. A 64, 112–122. Google Scholar
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G.
M. (2010). Experimental phasing ...
[
more
results from section 16.1.2 in volume F]
Avoiding false minima
Sheldrick, G. M.,
Gilmore, C. J.,
Hauptman, H. A.,
Weeks, C. M.,
Miller, R. and
Usón, I.,
International Tables for Crystallography
(2012).
Vol. F,
Section 16.1.10.1,
pp. 422-423
[ doi:10.1107/97809553602060000850 ]
represents a minimum of 256 trials.
References
Schäfer, M.,
Sheldrick,
G.
M., Schneider, T. R. & Vértesy, L. (1998). Structure of balhimycin and its complex with solvent molecules . Acta Cryst. D 54, 175–183. Google ...
[
more
results from section 16.1.10 in volume F]
Fourier refinement
Sheldrick, G. M.,
Gilmore, C. J.,
Hauptman, H. A.,
Weeks, C. M.,
Miller, R. and
Usón, I.,
International Tables for Crystallography
(2012).
Vol. F,
Section 16.1.6,
pp. 419-419
[ doi:10.1107/97809553602060000850 ]
Sheldrick,
G.
M. (1982). Crystallographic algorithms for mini- and maxi-computers . In Computational Crystallography, edited by D. Sayre, pp. 506–514. Oxford: Clarendon Press. Google Scholar
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G.
M. (1990). Phase annealing ...
Structure invariants
Sheldrick, G. M.,
Gilmore, C. J.,
Hauptman, H. A.,
Weeks, C. M.,
Miller, R. and
Usón, I.,
International Tables for Crystallography
(2012).
Vol. F,
Section 16.1.3.1,
pp. 416-417
[ doi:10.1107/97809553602060000850 ]
[
more
results from section 16.1.3 in volume F]
Substructure solution for native sulfurs and halide soaks
Sheldrick, G. M.,
Gilmore, C. J.,
Hauptman, H. A.,
Weeks, C. M.,
Miller, R. and
Usón, I.,
International Tables for Crystallography
(2012).
Vol. F,
Section 16.1.11,
pp. 425-426
[ doi:10.1107/97809553602060000850 ]
for phasing macromolecular structures: a powerful tool for structural genomics . Acta Cryst. D 57, 239–249. Google Scholar
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Sheldrick,
G.
M. (2003). Structure of viscotoxin A3 ...
Utilizing Pattersons for better starts
Sheldrick, G. M.,
Gilmore, C. J.,
Hauptman, H. A.,
Weeks, C. M.,
Miller, R. and
Usón, I.,
International Tables for Crystallography
(2012).
Vol. F,
Section 16.1.8,
pp. 419-420
[ doi:10.1107/97809553602060000850 ]
communication. Google Scholar
Sheldrick,
G.
M., Dauter, Z., Wilson, K. S., Hope, H. & Sieker, L. C. (1993). The application of direct methods and Patterson interpretation to high-resolution native protein data. Acta Cryst. D 49, 18–23 ...
