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staphlee

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[½»Á÷] XPREP: merge reflections? apply high/low resolution cutoffs?

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Select [D] to read, modify or merge datasets
Ö®ºóÑ¡Select [S] to display the intensity statistics
1.Ö®ºó³öÏÖ
  [N] Do not merge datasets
   [I] Merge Identical inducesonly
   [A] Merge ALL equivalents (including Friedel opposites)
   Ô¤ÉèÊÇ[A]
   µ½µ×ÊÇҪѡÄÄÒ»¸ö°¢??ÎÒÔõ¿´¹ýÓÐÈË˵ѡ[N]µÄÒ²ÓÐÈË˵Ҫѡ[A]
   ÕâЩÓкβ»Í¬ÒÔ¼°Ñ¡ÓõÄʱ»ú?

2.ÉÏÃæÑ¡ÍêÖ®ºó»á³öÏÖthe intensity statistics...
    ÎÒ¿´¹ýÊÖ²á˵Èç¹û%completeºÜµÍµÄ»°...Ҫɾµô
   ¶àµÍҪɾµôÄØ???
    »¹ÊDz»ÐèҪɾ??

3.Ö®ºóÑ¡ÓÃ[H] apply high/low resolution cutoffs
    ɾµô²»ÒªµÄÖ®ºó
   »¹ÐèÒª×÷1.ÖеÄmerge»ò²»merge??

4.È»ºóÊÇ[w] write dataset to file
    ÔÚ×öÍê2, 3Ö®ºó
   ÎÒÔõÓп´¹ýÊÖ²áûдÕâ¸ö²½ÖèµÄ,ÓеÄÊÖ²áÓÐд
   Õâ¸ö²½ÖèÐèÒª×öÂð??

5. XPREPÀïÃæÓÐ¹ØÆäËûµÄÑ¡Ïî...»¹ÓÐÄÄЩ»á³£Óõ½µÄ??
   ÄÄЩÊÇÌØÊâÀý×ÓÐèÒª×öµÄÄØ??

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staphlee

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2Â¥2009-07-10 15:35:05
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huihuijing6303

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3Â¥2009-07-10 17:47:16
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staphlee

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Originally posted by huihuijing6303 at 2009-7-10 17:47:
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4Â¥2009-07-11 08:24:51
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staphlee

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