²é¿´: 1379  |  »Ø¸´: 4

___garrett

½ð³æ (ÕýʽдÊÖ)


[½»Á÷] autodock ÅäÌåÎļþÔÚwindowsÏÂÌáÈ¡

¸ù¾ÝÍøÉϽ̳̣¬ÎÒÒѾ­°²×°ÁËcygwin£¬²¢ÇÒ°ÑcygwinµÄbinÎļþ¼Ð·Åµ½ÁËwindows»·¾³±äÁ¿Àï¡£

µÚÒ»²½ÌáÈ¡ËùÓеÄpdbqtÐÅÏ¢£º
grep '^DOCKED' my_docking.dlg | cut -c9- > my_docking.pdbqt
µÚ¶þ²½½«pdbqt¸ñʽת»¯Îªpdb¸ñ×Ó£¬Ò²¾ÍÊÇɾȥµçºÉºÍatomtypeµÄÁ½ÁÐÊý¾Ý£º
cut -c-66 my_docking.pdbqt > my_docking.pdb

Ö®ºóզŪ£¬Çó°ïÖú¡£ Ö®ºó»¹ÓÐûÓÐÁË£¬ÎÒզŪ²»Ã÷°×ÁË¡£

µ°ÒÑËé°¡£¡£¡£¡£¡£¡£¡
»Ø¸´´ËÂ¥

» ²ÂÄãϲ»¶

» ±¾Ö÷ÌâÏà¹Ø¼ÛÖµÌùÍÆ¼ö£¬¶ÔÄúͬÑùÓаïÖú:

» ÇÀ½ð±ÒÀ²£¡»ØÌû¾Í¿ÉÒԵõ½:

²é¿´È«²¿É¢½ðÌù

ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

smutao

½û³æ (ÖøÃûдÊÖ)

±¾ÌûÄÚÈݱ»ÆÁ±Î

2Â¥2014-01-05 19:05:55
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

longytu

¾èÖú¹ó±ö (ÕýʽдÊÖ)


¡ï ¡ï
Сľ³æ: ½ð±Ò+0.5, ¸ø¸öºì°ü£¬Ð»Ð»»ØÌû
ÔÂÖ»À¶: ½ð±Ò+1, ¹ÄÀø½»Á÷ 2014-01-23 23:46:14
ΪʲôŪµÄÕâô¸´ÔÓÄØ£¿
Ö±½ÓÓÃpymol·ÖÎö¶à¼òµ¥Ñ½
3Â¥2014-01-10 13:32:48
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

caixin5120

ľ³æ (ÕýʽдÊÖ)


¡ï ¡ï
ÔÂÖ»À¶: ½ð±Ò+2, ¹ÄÀø½»Á÷ 2014-01-12 09:19:11
µÄÈ·ÊǸöûÓÐŪÇå³þµÄÎÊÌ⣬Äãµ½µ×ÊÇÏë²é¿´½á¹û»¹ÊÇ·ÖÎö½á¹û£¿²é¿´½á¹ûAutod×Ô´øµÄMGLTools¾ÍÐС£

×÷ͼ·ÖÎöÔòpymol µÈ¶¼ºÃ¡£

PS£ºÏÖÔÚµÄAutodock MGLTools¸ù±¾²»ÐèÒª°²×°Ê²Ã´cywinÁË¡£

¹ØÓÚautodock vina½á¹ûµÄ²é¿´£¬¿ÉÒÔ¼ûÕâÀï http://bioms.org/forum-simulate_visualization-1.html

¹ØÓÚAutodockºÍvinaµÄʹÓÿÉÒÔ¼ûÕâÀïhttp://bioms.org/forum-autodock_vina-1.html
4Â¥2014-01-11 19:42:20
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

yangming98

½ð³æ (ÖøÃûдÊÖ)


·ÉÐÐ

[ ·¢×ÔСľ³æ¿Í»§¶Ë ]
5Â¥2014-01-23 22:12:58
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû
Ïà¹Ø°æ¿éÌø×ª ÎÒÒª¶©ÔÄÂ¥Ö÷ ___garrett µÄÖ÷Ìâ¸üÐÂ
×î¾ßÈËÆøÈÈÌûÍÆ¼ö [²é¿´È«²¿] ×÷Õß »Ø/¿´ ×îºó·¢±í
[¿¼ÑÐ] 0817 »¯Ñ§¹¤³Ì 299·ÖÇóµ÷¼Á ÓпÆÑо­Àú ÓжþÇøÎÄÕ +12 rare12345 2026-03-18 12/600 2026-03-19 14:41 by peike
[¿¼ÑÐ] ÕÐÊÕµ÷¼Á˶ʿ +3 lidianxing 2026-03-19 9/450 2026-03-19 13:59 by lidianxing
[¿¼ÑÐ] 0703»¯Ñ§µ÷¼Á +5 pupcoco 2026-03-17 8/400 2026-03-19 13:58 by houyaoxu
[¿¼ÑÐ] 346Çóµ÷¼Á[0856] +3 WayneLim327 2026-03-16 6/300 2026-03-19 11:21 by WayneLim327
[¿¼ÑÐ] 085600²ÄÁÏÓ뻯¹¤ +5 °²È«Éϰ¶£¡ 2026-03-16 5/250 2026-03-18 15:33 by cmz0325
[¿¼ÑÐ] ²ÄÁÏÓ뻯¹¤Ò»Ö¾Ô¸Äϲý´óѧ327Çóµ÷¼ÁÍÆ¼ö +8 Ncdx123456 2026-03-13 9/450 2026-03-18 14:40 by haxia
[¿¼ÑÐ] 0854¿É¿çµ÷¼Á£¬Ò»×÷Ò»ÏîºËÐÄÂÛÎÄÎåÏîרÀû£¬Ê¡¡¢¹ú¼¶Ö¤Êé40+ÊýÒ»Ó¢Ò»287 +8 СÀî0854 2026-03-16 8/400 2026-03-18 14:35 by ²«»÷518
[¿¼ÑÐ] Ò»Ö¾Ô¸Î÷ÄϽ»´ó£¬Çóµ÷¼Á +4 ²Ä»¯ÖðÃÎÈË 2026-03-18 4/200 2026-03-18 14:22 by 007_lilei
[¿¼ÑÐ] ²ÄÁÏר˶306Ó¢Ò»Êý¶þ +10 z1z2z3879 2026-03-16 13/650 2026-03-18 14:20 by 007_lilei
[¿¼ÑÐ] ¹¤¿Æ²ÄÁÏ085601 279Çóµ÷¼Á +6 À§ÓÚÐdz¿ 2026-03-17 6/300 2026-03-18 10:21 by kkcoco25
[¿¼ÑÐ] 334Çóµ÷¼Á +3 Ö¾´æ¸ßÔ¶ÒâÔÚ»úÐ 2026-03-16 3/150 2026-03-18 08:34 by lm4875102
[¿¼ÑÐ] 290Çóµ÷¼Á +6 ¿×Ö¾ºÆ 2026-03-12 11/550 2026-03-17 14:41 by ÖÜÖÛÖÛ77
[¿¼ÑÐ] Ò»Ö¾Ô¸£¬¸£ÖÝ´óѧ²ÄÁÏר˶339·ÖÇóµ÷¼Á +3 ľ×ÓmomoÇàÕù 2026-03-15 3/150 2026-03-17 07:52 by laoshidan
[¿¼ÑÐ] Ò»Ö¾Ô¸211 0703·½Ïò310·ÖÇóµ÷¼Á +3 ŬÁ¦·Ü¶·112 2026-03-15 3/150 2026-03-16 16:44 by houyaoxu
[¿¼ÑÐ] 285Çóµ÷¼Á +6 ytter 2026-03-12 6/300 2026-03-16 15:05 by njzyff
[¿¼ÑÐ] 0703»¯Ñ§µ÷¼Á 290·ÖÓпÆÑо­Àú£¬ÂÛÎÄÔÚͶ +7 ÄåÄågk 2026-03-14 7/350 2026-03-16 10:12 by houyaoxu
[¿¼ÑÐ] 326Çóµ÷¼Á +3 mlpqaz03 2026-03-15 3/150 2026-03-16 07:33 by Iveryant
[¿¼ÑÐ] 070305Çóµ÷¼Á +3 mlpqaz03 2026-03-14 4/200 2026-03-15 11:04 by peike
[»ù½ðÉêÇë] ÏÖÔÚÈçºÎ»Ø±ÜÈ¥ÄêµÄijһ¸öר¼Ò£¬²»ÖªµÀÃû×Ö +3 zk200107 2026-03-12 6/300 2026-03-14 17:13 by zk200107
[¿¼ÑÐ] 304Çóµ÷¼Á +7 7712b 2026-03-13 7/350 2026-03-13 21:42 by peike
ÐÅÏ¢Ìáʾ
ÇëÌî´¦ÀíÒâ¼û