| ²é¿´: 2533 | »Ø¸´: 8 | ||||
| µ±Ç°Ö»ÏÔʾÂú×ãÖ¸¶¨Ìõ¼þµÄ»ØÌû£¬µã»÷ÕâÀï²é¿´±¾»°ÌâµÄËùÓлØÌû | ||||
sjwangustcľ³æ (ÕýʽдÊÖ)
|
[½»Á÷]
¡¾ÇóÖú¡¿¼¸¸öAÀà´íÎóÈçºÎÐÞÕý£¿ ÒÑÓÐ1È˲ÎÓë
|
|||
|
Çë½ÌÈçϼ¸¸öAÀà´íÎóÈçºÎÐÞÕý£º £¨1£© Check High Ueq as Compared to Neighbors for N3 £¨2£©Check Low Ueq as Compared to Neighbors for C39 £¨3£©Coordinates do not Form a Properly Connected Set £¨4£©Too many H on C in C=N Moiety in Solvent/Ion ... C52 £¨5£©ADP of Atom N6 is N.P.D. or (nearly) 2D ... ? £¨6£©Large Non-Solvent C Ueq(max)/Ueq(min) ... 5.20 Ratio £¨7£©Atom C10 has ADP max/min Ratio ..... 15.90 prola |
» ÊÕ¼±¾ÌûµÄÌÔÌûר¼ÍƼö
µ¥¾§ |
» ²ÂÄãϲ»¶
ÔÚMOFÖУ¬ÓÐûÓÐôÈ»ù²Î¼ÓÅäλµÄÇé¿ö
ÒѾÓÐ2È˻ظ´
ÕÐ2026ÄêÈëѧÉϺ£½»Í¨´óѧ²©Ê¿Éú£¬¼±£¡£¡£¡
ÒѾÓÐ1È˻ظ´
ÎÞ»ú»¯Ñ§ÂÛÎÄÈóÉ«/·ÒëÔõôÊÕ·Ñ?
ÒѾÓÐ72È˻ظ´
ÀíÂÛ¼ÆËãºÏ×÷
ÒѾÓÐ0È˻ظ´
Çó¸ßУºÏ×÷
ÒѾÓÐ1È˻ظ´
27¼¶ÎÞ»ú»¯Ñ§É격×Ô¼ö
ÒѾÓÐ2È˻ظ´
ChemdrawÃâ·ÑÈí¼þ
ÒѾÓÐ0È˻ظ´
µ¥¾§½á¹¹½âÎö£¬¸÷ÀàÒÉÄѾ§ÌåÊý¾Ý´¦ÀíºÍ´ðÒÉ
ÒѾÓÐ38È˻ظ´
Õâ¸öË®Ïà·´Ó¦ÓÐûÓд߻¯¼Á´Ù½ø·¢Éú
ÒѾÓÐ4È˻ظ´
Mn Me3TACN
ÒѾÓÐ5È˻ظ´
» ±¾Ö÷ÌâÏà¹Ø¼ÛÖµÌùÍÆ¼ö£¬¶ÔÄúͬÑùÓаïÖú:
À´²»¼°ÐÞÕý¸Õ·¢ÏֵĴíÎóÁË£¬Çó°²Î¿¡
ÒѾÓÐ5È˻ظ´
check cifʱµÄAÀà´íÎóÉæ¼°¿Õ¼äȺ ÈçºÎÐ޸ģ¿
ÒѾÓÐ7È˻ظ´
CheckcifÓÐAÀàºÍBÀà´íÎó£¬ÊDz»ÊÇÒªÐÞÕý°¡£¬Òª²»È»¾Í·¢²»ÁËÎÄÕ£¿
ÒѾÓÐ3È˻ظ´
CIFÎļþÖеÄAÀà´íÎóÈçºÎÐ޸ģ¨ X-H Bonds and X-Y-H or H-Y-H Angles £©£¿
ÒѾÓÐ3È˻ظ´
¼¸¸öAÀà´íÎó£¬Çó¸ßÊÖÖ¸µã£¡
ÒѾÓÐ4È˻ظ´
ÇóÖú£º cifÖеÄAÀà´íÎó
ÒѾÓÐ9È˻ظ´
¡¾ÇóÖú¡¿ÔõÑùÐÞ¸ÄÎå¸öBÀà´íÎó
ÒѾÓÐ3È˻ظ´
¡¾ÇóÖú¡¿ÓÃcounter×öbsseÐÞÕýÈý¸öÔ×ÓÆ¬¶Îʱ³ö´í
ÒѾÓÐ7È˻ظ´
¡¾Çë½Ì¡¿ÔÚcheckcifÖгöÏÖaºÍb´íÎó£¬Ó¦¸ÃÈçºÎÐ޸ģ¿
ÒѾÓÐ5È˻ظ´
¡¾ÇóÖú¡¿ºÏ³É°±¹ý³ÌÄ£Äâ ½á¹û´íÎó£¬Ôõô°ì£¿²¢ÎÊÏÂÈçºÎÐÞ¸ÄÊÕÁ²´ÎÊý£¡¡¾Òѽâ¾ö¡¿
ÒѾÓÐ11È˻ظ´
¡¾ÇóÖú¡¿Ph¼ÆÐ£Õý´íÎóÔõô°ì
ÒѾÓÐ24È˻ظ´
hjh509
Ìú¸Ëľ³æ (Ö°Òµ×÷¼Ò)
- CMEI: 1
- Ó¦Öú: 46 (СѧÉú)
- ½ð±Ò: 7743.1
- É¢½ð: 35
- ºì»¨: 23
- ɳ·¢: 120
- Ìû×Ó: 3915
- ÔÚÏß: 327.5Сʱ
- ³æºÅ: 797728
- ×¢²á: 2009-06-23
- רҵ: Óлú½ðÊô»¯Ñ§

3Â¥2010-10-20 08:49:27
nokian1985
ľ³æ (ÕýʽдÊÖ)
- Ó¦Öú: 13 (СѧÉú)
- ½ð±Ò: 1537.2
- É¢½ð: 503
- ºì»¨: 1
- Ìû×Ó: 319
- ÔÚÏß: 823.8Сʱ
- ³æºÅ: 476007
- ×¢²á: 2007-12-09
- ÐÔ±ð: GG
- רҵ: Åäλ»¯Ñ§
¡ï
nash603(½ð±Ò+1):лл»ØÌù½»Á÷£¡ 2010-10-20 08:36:59
sjwangustc(½ð±Ò+1): 2010-10-20 09:13:38
nash603(½ð±Ò+1):лл»ØÌù½»Á÷£¡ 2010-10-20 08:36:59
sjwangustc(½ð±Ò+1): 2010-10-20 09:13:38
| ÎÊÌâºÜ¶à°¡£¬£¬Ã¿¸öÔ×ÓÔٺúÃÐÞÒ»ÐÞ |
2Â¥2010-10-19 21:57:19
xglegl
ľ³æ (ÕýʽдÊÖ)
- Ó¦Öú: 0 (Ó×¶ùÔ°)
- ½ð±Ò: 3637.4
- É¢½ð: 120
- Ìû×Ó: 359
- ÔÚÏß: 287.7Сʱ
- ³æºÅ: 629852
- ×¢²á: 2008-10-18
- רҵ: Åäλ»¯Ñ§
4Â¥2010-10-20 09:10:29
sjwangustc
ľ³æ (ÕýʽдÊÖ)
- CMEI: 2
- Ó¦Öú: 12 (СѧÉú)
- ½ð±Ò: 5955.9
- É¢½ð: 846
- ºì»¨: 24
- Ìû×Ó: 820
- ÔÚÏß: 165.1Сʱ
- ³æºÅ: 740369
- ×¢²á: 2009-04-04
- רҵ: ÔªËØ»¯Ñ§
5Â¥2010-10-20 09:14:25









»Ø¸´´ËÂ¥
20