| ²é¿´: 1219 | »Ø¸´: 6 | ||
¹¤´óÐÂÉúÒø³æ (ÕýʽдÊÖ)
|
[ÇóÖú]
Autodock ÖÐÄÜÁ¿µÄÎÊÌâ
|
| ÔÚʹÓÃAutodock¶Ô½ÓÉúÎï´ó·Ö×Ó£¨DNA£©ºÍÒ©ÎïµÄʱºò£¬²é¿´Á˶Խӽá¹ûµÄÇâ¼üÄÜ£¬·¢ÏÖÐγɺü¸¸öÇâ¼ü£¬°ÑÕ⼸¸öÇâ¼üÄÜÏà¼ÓµÃµ½µÄ×ÜÇâ¼üÄÜ´óÓÚ the sum of Van der Waals energy, hydrogen bonding energy and desolvation free energy£¬ÈçºÎ½âÊÍÕâÒ»ÎÊÌ⣿ |
» ²ÂÄãϲ»¶
»¯Ñ§¹¤³Ì321·ÖÇóµ÷¼Á
ÒѾÓÐ7È˻ظ´
0703»¯Ñ§µ÷¼Á 290·ÖÓпÆÑоÀú£¬ÂÛÎÄÔÚͶ
ÒѾÓÐ7È˻ظ´
308Çóµ÷¼Á
ÒѾÓÐ3È˻ظ´
±¾ÈË¿¼085602 »¯Ñ§¹¤³Ì ר˶
ÒѾÓÐ10È˻ظ´
½¹ÂÇ
ÒѾÓÐ9È˻ظ´
0856Çóµ÷¼Á
ÒѾÓÐ3È˻ظ´
283Çóµ÷¼Á
ÒѾÓÐ11È˻ظ´
ÉîÛÚ´óѧ˶ʿÕÐÉú£¨2026Ç´«¸ÐÆ÷·½Ïò£¬½ö¼ȡµÚÒ»Ö¾Ô¸£©
ÒѾÓÐ8È˻ظ´
0703»¯Ñ§µ÷¼Á
ÒѾÓÐ7È˻ظ´
344Çóµ÷¼Á
ÒѾÓÐ3È˻ظ´
» ±¾Ö÷ÌâÏà¹ØÉ̼ÒÍÆ¼ö: (ÎÒÒ²ÒªÔÚÕâÀïÍÆ¹ã)
» ±¾Ö÷ÌâÏà¹Ø¼ÛÖµÌùÍÆ¼ö£¬¶ÔÄúͬÑùÓаïÖú:
¹ØÓÚÏ¡ÍÁÀë×ÓÄÜÁ¿´«µÝµÄÎÊÌâ¡£
ÒѾÓÐ7È˻ظ´
Çë½Ì¸ß˹09ËãÈܼÁЧӦ¼°ÄÜÁ¿Ð£ÕýÎÊÌ⣬¶àËͽð±Ò+Сºì»¨
ÒѾÓÐ19È˻ظ´
ÓйØAutodock½á¹û·ÖÎöÖнáºÏ×ÔÓÉÄܵÄÎÊÌâ
ÒѾÓÐ6È˻ظ´
ÇóÖú¹ØÓÚÓ«¹â¹²ÕñÄÜÁ¿×ªÒƵÄÎÊÌ⣿
ÒѾÓÐ8È˻ظ´
AutodockÔÚUbuntuϵݲװÎÊÌâ
ÒѾÓÐ7È˻ظ´
vasp5.2 openmpi+intel+mkl±àÒ룬ÄÜÁ¿ÕýÖµÎÊÌâ
ÒѾÓÐ7È˻ظ´
Ìåϵ¾ø¶ÔÄÜÁ¿µÄÎÊÌâ
ÒѾÓÐ4È˻ظ´
AutoDock²ÎÊýÉèÖÃÎÊÌâ
ÒѾÓÐ6È˻ظ´
ÓÃAutoDock×÷·Ö×Ó¶Ô½ÓǰµÄС·Ö×ÓÄÜÁ¿×îС»¯ÎÊÌâ
ÒѾÓÐ6È˻ظ´
¡¾ÇóÖú¡¿win7ϰ²×°AUTODOCK³öÏÖÎÊÌ⣬Çó°ïÖú(¸½½ØÍ¼£©
ÒѾÓÐ17È˻ظ´
¡¾ÇóÖú¡¿autodock4 °²×°ÎÊÌâ
ÒѾÓÐ9È˻ظ´
¡¾ÇóÖú¡¿autodockÖÐPDBתpdbqt¸ñʽÎÊÌ⣿
ÒѾÓÐ9È˻ظ´
¡¾ÌÖÂÛ¡¿¹ØÓÚ·¢¹â²ÄÁÏÄÜÁ¿´«µÝµÄһЩÎÊÌâ¡£
ÒѾÓÐ23È˻ظ´
¡¾ÇóÖú¡¿·Ö×ÓÄ£Äâ×ÜÄÜÁ¿ÊÇ·ñÒ»¶¨Ð¡ÓÚ0£¿
ÒѾÓÐ13È˻ظ´
¡¾ÇóÖú¡¿·ÅµçÇúÏß¼ÆËã±ÈÄÜÁ¿ºÍ±È¹¦ÂʵÄÎÊÌâ
ÒѾÓÐ6È˻ظ´
¼¸¸öºÏ½ðÄÜÁ¿Ñ§·½ÃæµÄÎÊÌâ
ÒѾÓÐ3È˻ظ´
¡¾ÇóÖú¡¿¹ØÓÚAutodockÖÐGridÖеÄÎÊÌâ
ÒѾÓÐ9È˻ظ´
¹¤´óÐÂÉú
Òø³æ (ÕýʽдÊÖ)
- Ó¦Öú: 2 (Ó×¶ùÔ°)
- ½ð±Ò: 20.6
- É¢½ð: 418
- ºì»¨: 4
- Ìû×Ó: 729
- ÔÚÏß: 281.8Сʱ
- ³æºÅ: 1395000
- ×¢²á: 2011-09-08
- ÐÔ±ð: GG
- רҵ: Óлú·ÖÎö
2Â¥2013-08-22 10:38:16
¹¤´óÐÂÉú
Òø³æ (ÕýʽдÊÖ)
- Ó¦Öú: 2 (Ó×¶ùÔ°)
- ½ð±Ò: 20.6
- É¢½ð: 418
- ºì»¨: 4
- Ìû×Ó: 729
- ÔÚÏß: 281.8Сʱ
- ³æºÅ: 1395000
- ×¢²á: 2011-09-08
- ÐÔ±ð: GG
- רҵ: Óлú·ÖÎö
3Â¥2013-08-22 11:08:16
caixin5120
ľ³æ (ÕýʽдÊÖ)
- Ä£ÄâEPI: 1
- Ó¦Öú: 46 (СѧÉú)
- ½ð±Ò: 5.9
- É¢½ð: 100
- ºì»¨: 3
- Ìû×Ó: 483
- ÔÚÏß: 158.3Сʱ
- ³æºÅ: 576460
- ×¢²á: 2008-06-20
- רҵ: Ò©Îﻯѧ
¡¾´ð°¸¡¿Ó¦Öú»ØÌû
¸Ðл²ÎÓ룬ӦÖúÖ¸Êý +1
|
¿ÉÒÔ¿´¿´Õâ¸öÌû×Ó£¬ÉîÈëѧϰÏÂautodockµÄ˵Ã÷Ê飡 http://muchong.com/bbs/viewthread.php?tid=5214127&fpage=1 |
4Â¥2013-08-22 11:38:21
¹¤´óÐÂÉú
Òø³æ (ÕýʽдÊÖ)
- Ó¦Öú: 2 (Ó×¶ùÔ°)
- ½ð±Ò: 20.6
- É¢½ð: 418
- ºì»¨: 4
- Ìû×Ó: 729
- ÔÚÏß: 281.8Сʱ
- ³æºÅ: 1395000
- ×¢²á: 2011-09-08
- ÐÔ±ð: GG
- רҵ: Óлú·ÖÎö
5Â¥2013-08-22 17:30:12
¹¤´óÐÂÉú
Òø³æ (ÕýʽдÊÖ)
- Ó¦Öú: 2 (Ó×¶ùÔ°)
- ½ð±Ò: 20.6
- É¢½ð: 418
- ºì»¨: 4
- Ìû×Ó: 729
- ÔÚÏß: 281.8Сʱ
- ³æºÅ: 1395000
- ×¢²á: 2011-09-08
- ÐÔ±ð: GG
- רҵ: Óлú·ÖÎö
6Â¥2013-08-23 08:52:45
¹¤´óÐÂÉú
Òø³æ (ÕýʽдÊÖ)
- Ó¦Öú: 2 (Ó×¶ùÔ°)
- ½ð±Ò: 20.6
- É¢½ð: 418
- ºì»¨: 4
- Ìû×Ó: 729
- ÔÚÏß: 281.8Сʱ
- ³æºÅ: 1395000
- ×¢²á: 2011-09-08
- ÐÔ±ð: GG
- רҵ: Óлú·ÖÎö
7Â¥2013-08-23 21:09:20













»Ø¸´´ËÂ¥