The structure solution of small molecules is, nowdays, almost a routine process; the ab initio structure solution of macromolecules is, on the country, a challenge for anu crystallographic software. Four programs are well documented: Shake-and-bake (Weeks et al.,1994), SHELX-D (Sheldrick, 1998), ACORN (Foadi et al., 2000) and SIR2000-N (Burla el al.,2001). A new direct-methods program, SIR2002 (Burla et al.,2002), has been designed to solve both small and large crystal structures.
SIR2002: the program
Camalli M;Carrozzini B;Cascarano GL;Spagna R
2003
Abstract
The structure solution of small molecules is, nowdays, almost a routine process; the ab initio structure solution of macromolecules is, on the country, a challenge for anu crystallographic software. Four programs are well documented: Shake-and-bake (Weeks et al.,1994), SHELX-D (Sheldrick, 1998), ACORN (Foadi et al., 2000) and SIR2000-N (Burla el al.,2001). A new direct-methods program, SIR2002 (Burla et al.,2002), has been designed to solve both small and large crystal structures.File in questo prodotto:
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