| ²é¿´: 3629 | »Ø¸´: 32 | ||||
| ¡¾½±Àø¡¿ ±¾Ìû±»ÆÀ¼Û28´Î£¬×÷Õ߼ÈÝÏɳ¾Ôö¼Ó½ð±Ò 22.2 ¸ö | ||||
[×ÊÔ´]
OPLSaa²ÎÊýÎļþ
|
||||
| ֮ǰģÄâÎïÖÊÕÒ²»µ½OPLSaaÁ¦³¡µÄ²ÎÊý£¬ºóÀ´µ½Ò»¸öÍøÕ¾ÉÏÕÒµ½ÁËÒ»·ÝExcelµÄÎļþ£¬Àï±ßµÄ²ÎÊýºÜÈ«£¬¶øÇ񼆮äËûÎÄÏ×Ò²¶ÔÕÕ¹ý£¬Ö®Ç°ÂÛ̳ҲÓÐÈË·¢ÁËÏà¹ØµÄÎÄÕ£¬µ«ÊDzÎÊý²»ÊǺÜÈ«£¬ËùÒÔ¸ú´ó¼Ò·ÖÏíһϣ¬ÒÔºó¾Í²»ÓÃÔÙÈ¥ÕÒÍøÕ¾ÁË |
» ±¾Ìû¸½¼þ×ÊÔ´Áбí
-
»¶Ó¼à¶½ºÍ·´À¡£ºÐ¡Ä¾³æ½öÌṩ½»Á÷ƽ̨£¬²»¶Ô¸ÃÄÚÈݸºÔð¡£
±¾ÄÚÈÝÓÉÓû§×ÔÖ÷·¢²¼£¬Èç¹ûÆäÄÚÈÝÉæ¼°µ½ÖªÊ¶²úȨÎÊÌ⣬ÆäÔðÈÎÔÚÓÚÓû§±¾ÈË£¬Èç¶Ô°æÈ¨ÓÐÒìÒ飬ÇëÁªÏµÓÊÏ䣺xiaomuchong@tal.com - ¸½¼þ 1 : oplsaa²ÎÊý.ods
2016-11-22 16:12:22, 929.73 K
» ÊÕ¼±¾ÌûµÄÌÔÌûר¼ÍƼö
·Ö×ÓÄ£Äâ |
» ²ÂÄãϲ»¶
311£¨085601£©Çóµ÷¼Á
ÒѾÓÐ4È˻ظ´
305Çóµ÷¼Á
ÒѾÓÐ4È˻ظ´
Ò»Ö¾Ô¸±±»¯085600²ÄÁÏר˶275|ÓÐÎÄÕÂרÀû£üÇóµ÷¼Á
ÒѾÓÐ7È˻ظ´
Ò»Ö¾Ô¸»ªÀí£¬ÊýÒ»Ó¢Ò»285ÇóAÇøµ÷¼Á
ÒѾÓÐ12È˻ظ´
289Çóµ÷¼Á
ÒѾÓÐ11È˻ظ´
ʳƷ¹¤³Ìר˶һ־ԸÖк£Ñó309Çóµ÷¼Á
ÒѾÓÐ7È˻ظ´
ÉúÎïѧѧ˶£¬Ò»Ö¾Ô¸ºþÄÏ´óѧ£¬³õÊԳɼ¨338
ÒѾÓÐ6È˻ظ´
321Çóµ÷¼Á
ÒѾÓÐ7È˻ظ´
343Çóµ÷¼Á
ÒѾÓÐ4È˻ظ´
±¾¿ÆÐÂÄÜÔ´¿ÆÑ§Ó빤³Ì£¬Ò»Ö¾Ô¸»ªÀíÄܶ¯285Çóµ÷¼Á
ÒѾÓÐ6È˻ظ´
» ±¾Ö÷ÌâÏà¹Ø¼ÛÖµÌùÍÆ¼ö£¬¶ÔÄúͬÑùÓаïÖú:
OPLSAAÁ¦³¡MDÄ£ÄâʱmdpÎļþ
ÒѾÓÐ0È˻ظ´
gromacs Ìí¼ÓеÄÁ¦³¡pdb2gmx±¨´í
ÒѾÓÐ5È˻ظ´
tip5pË®·Ö×ÓÓë×Ô¶¨ÒåÔ×ÓµÄL-J²ÎÊý¹¹ÔìÓëѹÁ¦¿ØÖƵÈÎÊÌâ
ÒѾÓÐ0È˻ظ´
ÄÜÁ¿ÓÅ»¯Ê±³ö´í
ÒѾÓÐ2È˻ظ´
¡ï¡ï¡ï¡ï¡ï ÎåÐǼ¶,ÓÅÐãÍÆ¼ö
|
https://dasher.wustl.edu/tinker/distribution/params/oplsaa.prm ÕâÊÇÎÒÒ»°ãÇé¿öÏÂÓõÄOPLS-AA²ÎÊý£¬Ï£ÍûÓаïÖú |
3Â¥2016-11-22 22:38:13
4Â¥2016-11-23 10:15:04
25Â¥2019-03-10 17:56:56
27Â¥2019-10-02 16:40:59
¼òµ¥»Ø¸´
liaoÁÎ2Â¥
2016-11-22 19:37
»Ø¸´
ÎåÐÇºÃÆÀ ¶¥Ò»Ï£¬¸Ðл·ÖÏí£¡
wbyo7215Â¥
2016-11-23 10:57
»Ø¸´
ÎåÐÇºÃÆÀ ¶¥Ò»Ï£¬¸Ðл·ÖÏí£¡
biancheng1596Â¥
2016-11-24 18:48
»Ø¸´
ÎåÐÇºÃÆÀ ¶¥Ò»Ï£¬¸Ðл·ÖÏí£¡
Vivianswy7Â¥
2017-01-06 15:12
»Ø¸´
ÎåÐÇºÃÆÀ ¶¥Ò»Ï£¬¸Ðл·ÖÏí£¡
Vivianswy8Â¥
2017-01-06 15:14
»Ø¸´
¶¥Ò»Ï£¬¸Ðл·ÖÏí£¡
fangsteel9Â¥
2017-01-06 15:33
»Ø¸´
ÎåÐÇºÃÆÀ ¶¥Ò»Ï£¬¸Ðл·ÖÏí£¡
zsilence10Â¥
2017-01-07 16:01
»Ø¸´
ÎåÐÇºÃÆÀ ¶¥Ò»Ï£¬¸Ðл·ÖÏí£¡
WWW×¢²á11Â¥
2017-01-11 23:34
»Ø¸´
ÎåÐÇºÃÆÀ ¶¥Ò»Ï£¬¸Ðл·ÖÏí£¡
maomao910912Â¥
2017-02-20 19:06
»Ø¸´
ÎåÐÇºÃÆÀ ¶¥Ò»Ï£¬¸Ðл·ÖÏí£¡
v75567713Â¥
2017-03-14 10:49
»Ø¸´
ÎåÐÇºÃÆÀ ¶¥Ò»Ï£¬¸Ðл·ÖÏí£¡
Invoker_kael14Â¥
2017-03-15 13:06
»Ø¸´
ÎåÐÇºÃÆÀ ¶¥Ò»Ï£¬¸Ðл·ÖÏí£¡
Õ¹ÅÎ201215Â¥
2017-12-04 13:34
»Ø¸´
ÎåÐÇºÃÆÀ ¶¥Ò»Ï£¬¸Ðл·ÖÏí£¡
¿¦É½×ϱ¦Ê¯16Â¥
2018-01-04 21:01
»Ø¸´
ÎåÐÇºÃÆÀ ¶¥Ò»Ï£¬¸Ðл·ÖÏí£¡
suihg17Â¥
2018-01-08 20:24
»Ø¸´
ÎåÐÇºÃÆÀ ¶¥Ò»Ï£¬¸Ðл·ÖÏí£¡
lyp_ontheway18Â¥
2018-01-13 16:55
»Ø¸´
ÎåÐÇºÃÆÀ ¶¥Ò»Ï£¬¸Ðл·ÖÏí£¡
wuÅéÈ»Ð͝19Â¥
2018-01-16 21:08
»Ø¸´
ÎåÐÇºÃÆÀ ¶¥Ò»Ï£¬¸Ðл·ÖÏí£¡
Chasing-Star20Â¥
2018-01-30 16:29
»Ø¸´
ÎåÐÇºÃÆÀ ¶¥Ò»Ï£¬¸Ðл·ÖÏí£¡
dzÃÎØ¼´º21Â¥
2018-02-06 20:00
»Ø¸´
ÎåÐÇºÃÆÀ ¶¥Ò»Ï£¬¸Ðл·ÖÏí£¡
112107836622Â¥
2018-02-27 11:49
»Ø¸´
ÎåÐÇºÃÆÀ ¶¥Ò»Ï£¬¸Ðл·ÖÏí£¡
niemingyang23Â¥
2018-09-05 23:06
»Ø¸´
ÎåÐÇºÃÆÀ ¶¥Ò»Ï£¬¸Ðл·ÖÏí£¡
ÖÜÇàÇà24Â¥
2019-03-10 16:32
»Ø¸´
ÎåÐÇºÃÆÀ ¶¥Ò»Ï£¬¸Ðл·ÖÏí£¡
°¢¼ªÄãÐÐ26Â¥
2019-08-29 15:02
»Ø¸´
ÎåÐÇºÃÆÀ ¶¥Ò»Ï£¬¸Ðл·ÖÏí£¡
aken555528Â¥
2020-02-02 14:23
»Ø¸´
ÎåÐÇºÃÆÀ 



12syh3429Â¥
2020-07-30 09:35
»Ø¸´
ÎåÐÇºÃÆÀ ¶¥Ò»Ï£¬¸Ðл·ÖÏí£¡
wo33597912330Â¥
2020-11-18 11:18
»Ø¸´
ÎåÐÇºÃÆÀ ¶¥Ò»Ï£¬¸Ðл·ÖÏí£¡
akyw123431Â¥
2020-11-18 19:43
»Ø¸´
ÈýÐÇºÃÆÀ ¶¥Ò»Ï£¬¸Ðл·ÖÏí£¡
104362454432Â¥
2022-03-31 16:33
»Ø¸´
ÎåÐÇºÃÆÀ ¸Ðл·ÖÏí
104362454433Â¥
2022-03-31 16:34
»Ø¸´
¶¥Ò»Ï£¬¸Ðл·ÖÏí£¡














»Ø¸´´ËÂ¥