DEVELOPMENTS IN THE MITHRIL DIRECT METHODS PROGRAM

被引:17
作者
GILMORE, CJ
BROWN, SR
机构
关键词
D O I
10.1107/S0021889888005394
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
A major upgrade to the MITHRIL direct-methods computer program is described. This includes a symbolic addition module for centrosymmetric structures, an E magnitude filtering method, the generation of missing weak intensity data, the computation of standard deviations for E magnitudes and a review system for exploring structures where the figures of merit are contradictory. The program has also been re-dimensioned to allow larger structures to be attempted, and easy provision has been made for both the UNIX and VMS operating systems. © 1988, Wiley-Blackwell. All rights reserved.
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页码:571 / 572
页数:2
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