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jianchen7882

½ð³æ (СÓÐÃûÆø)

[ÇóÖú] gromacsÇâ¼ü·ÖÎö¹¤¾ß£¬g_hbondÊä³ö½á¹û½âÎö£¿ ÒÑÓÐ1È˲ÎÓë

ÈçÌ⣬Çë½Ì¸÷λ´óÉñ£¬g_hbond·ÖÎö¹¤¾ßÊä³öµÄ½á¹ûÓÐÈýÁУ¬µÚÒ»ÁÐÊÇʱ¼ä£¬ºóÁ½ÁÐÊÇÇâ¼üÊýÁ¿£¬ÕâÀï·ÖÎöµÄÊÇÊÜÌåºÍÅäÌåÀ­ÉìʱµÄÇâ¼üÊýÁ¿£¬ÇëÎÊΪɶÊÇÁ½ÁÐÇâ¼üÊýÁ¿°¡£¿£¿
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jianchen7882

½ð³æ (СÓÐÃûÆø)

Ëͺ컨һ¶ä
ÒýÓûØÌû:
2Â¥: Originally posted by Ë®¶ùCoCo at 2014-06-10 15:09:18
µÃ³öµÄÎļþÀï×îÉÏÃæ·ÇÊý¾ÝÄǼ¸ÐÐÀïÓÐдÃ÷ÊÇʲô£¬Â¥Ö÷×¢Òâ´ò¿ªÀ´¿´¿´¾ÍÖªµÀÁË

лл£¬Êä³ö²ÎÊýÈçÏ£¬¾ßÌå½âÊÍһϺÃÂð£¬Ð»Ð»£¡£¡1
# This file was created Mon May 26 20:35:37 2014               
# by the following command:               
# g_hbond -f traj.xtc -s pull.tpr -num num.xvg                
#               
# g_hbond is part of G R O M A C S:               
#               
# GROningen Mixture of Alchemy and Childrens' Stories               
#               
"@    title ""Hydrogen Bonds"""               
"@    xaxis  label ""Time (ps)"""               
"@    yaxis  label ""Number"""               
@TYPE xy               
"@ view 0.15, 0.15, 0.75, 0.85"               
@ legend on               
@ legend box on               
@ legend loctype view               
"@ legend 0.78, 0.8"               
@ legend length 2               
"@ s0 legend ""Hydrogen bonds"""               
"@ s1 legend ""Pairs within 0.35 nm"""               
0        1        3
1        1        3
2        2        1
3        4        3
4        3        1
5        2        5
6        3        1
7        3        2
8        3        1
9        3        1
ĪÎÊǰ³ÌÓй飬µ«Çó½ñÉúÎÞ»Ú
3Â¥2014-06-10 20:35:47
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû
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Ë®¶ùCoCo

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jianchen7882: ½ð±Ò+10, ¡ï¡ï¡ï¡ï¡ï×î¼Ñ´ð°¸, ´ð°¸ÔÚºóÃæ£¬Í¦ºÃµÄ£¬Ð»Ð» 2014-06-14 08:27:43
ÔÂÖ»À¶: ½ð±Ò+2, ¸Ðлָµ¼£¡ 2014-06-17 15:57:08
µÃ³öµÄÎļþÀï×îÉÏÃæ·ÇÊý¾ÝÄǼ¸ÐÐÀïÓÐдÃ÷ÊÇʲô£¬Â¥Ö÷×¢Òâ´ò¿ªÀ´¿´¿´¾ÍÖªµÀÁË

» ±¾ÌûÒÑ»ñµÃµÄºì»¨£¨×îÐÂ10¶ä£©

2Â¥2014-06-10 15:09:18
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

Ë®¶ùCoCo

ľ³æ (СÓÐÃûÆø)

¡ï ¡ï
ÔÂÖ»À¶: ½ð±Ò+2, ¹ÄÀø½»Á÷£¡ 2014-06-17 15:57:22
ÒýÓûØÌû:
3Â¥: Originally posted by jianchen7882 at 2014-06-10 20:35:47
лл£¬Êä³ö²ÎÊýÈçÏ£¬¾ßÌå½âÊÍһϺÃÂð£¬Ð»Ð»£¡£¡1
# This file was created Mon May 26 20:35:37 2014               
# by the following command:               
# g_hbond -f traj.xtc -s pull.tpr -num num.xvg                
#               
# g_hbond  ...

µÚÒ»ÁÐÊÇʱ¼ä£¬µÚ¶þÁÐÊÇÇâ¼üÊýÄ¿£¬µÚÈýÁÐÊÇpairs with 0.35 nm

» ±¾ÌûÒÑ»ñµÃµÄºì»¨£¨×îÐÂ10¶ä£©

4Â¥2014-06-10 21:19:02
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

jianchen7882

½ð³æ (СÓÐÃûÆø)

Ëͺ컨һ¶ä
ÒýÓûØÌû:
4Â¥: Originally posted by Ë®¶ùCoCo at 2014-06-10 21:19:02
µÚÒ»ÁÐÊÇʱ¼ä£¬µÚ¶þÁÐÊÇÇâ¼üÊýÄ¿£¬µÚÈýÁÐÊÇpairs with 0.35 nm...

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