Znn3bq.jpeg
²é¿´: 1412  |  »Ø¸´: 4
µ±Ç°Ö»ÏÔʾÂú×ãÖ¸¶¨Ìõ¼þµÄ»ØÌû£¬µã»÷ÕâÀï²é¿´±¾»°ÌâµÄËùÓлØÌû

dndxwoaini

гæ (СÓÐÃûÆø)

[½»Á÷] ¡¾ÌÖÂÛ¡¿gromacs ²¢ÐÐ mpirun ÒÑÓÐ4È˲ÎÓë

gmx4.05  ÎÒÓÃÏÂÃæÕâ¸öÃüÁîÒ²ÄÜÅÜÆðÀ´£¬Ò²ÏÔʾ2¸öcpuÔÚ¹¤×÷£¬¿ÉÊÇËù»¯µÄʱ¼äºÍ²»²¢ÐÐÊÇÒ»ÑùµÄ£¬ÉõÖÁ»¹¶àµã£¬ÎªÊ²Ã´£¿
mpirun  C mdrun -s topol.tpr
»Ø¸´´ËÂ¥

» ²ÂÄãϲ»¶

» ±¾Ö÷ÌâÏà¹Ø¼ÛÖµÌùÍÆ¼ö£¬¶ÔÄúͬÑùÓаïÖú:

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

zh1987hs

½ð³æ (ÖøÃûдÊÖ)

·Ö×ÓÄ£ÄâÐÂÊÖ

¡ï ¡ï ¡ï ¡ï ¡ï
Сľ³æ(½ð±Ò+0.5):¸ø¸öºì°ü£¬Ð»Ð»»ØÌû½»Á÷
ghcacj(½ð±Ò+3): лл 2011-03-25 13:19:53
Óù½£½­ºþ(½ð±Ò+1): лл 2011-04-05 19:50:36
ÒýÓûØÌû:
Originally posted by dndxwoaini at 2011-03-16 00:03:50:
gmx4.05  ÎÒÓÃÏÂÃæÕâ¸öÃüÁîÒ²ÄÜÅÜÆðÀ´£¬Ò²ÏÔʾ2¸öcpuÔÚ¹¤×÷£¬¿ÉÊÇËù»¯µÄʱ¼äºÍ²»²¢ÐÐÊÇÒ»ÑùµÄ£¬ÉõÖÁ»¹¶àµã£¬ÎªÊ²Ã´£¿
mpirun  C mdrun -s topol.tpr

Õâ¸öÎÊÌâÎÒÒ²Óöµ½¹ý£¬Çë½ÌÁ˺ܶàÈË»¹ÊÇûÓнâ¾ö£¬²»ÖªµÀÊDz»ÊDz¢ÐгÌÐòºÍÄãµÄCPU¼æÈÝÐÔ²»ºÃµÄÔ­Òò£¬ÎÒÊÇÖ±½Ó°²×°ÁËGMX4.5.3Ö®ºóºÃÓõģ¬ÎÒµÄCPUÊÇI3£¬ÓõÄÊÇCMAKE±àÒë¡£
3Â¥2011-03-16 22:40:08
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû
²é¿´È«²¿ 5 ¸ö»Ø´ð

xiaowu759

Ìú¸Ëľ³æ (ÖøÃûдÊÖ)

ÃüÁîÐÐÓдíÎó°É£¿
2Â¥2011-03-16 20:27:38
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

dndxwoaini

гæ (СÓÐÃûÆø)

лл£¬ÎÊÌâÒѽâ¾ö£¬ÖØÐ°²×°Á˾ͺÃÁË
4Â¥2011-03-25 12:12:33
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

datian827

Òø³æ (СÓÐÃûÆø)

¡ï
Сľ³æ(½ð±Ò+0.5):¸ø¸öºì°ü£¬Ð»Ð»»ØÌû½»Á÷
Õâ¸öÎÊÌâÎÒÒ²¾À½áÁ˺ü¸ÌìÁË£¬¿´ÁËÕâ¸öÌû×Óºó£¬ÎÒ¹û¶Ï¾ö¶¨£¬»»¸ö°æ±¾ÊÔÊÔ
5Â¥2011-04-04 21:38:47
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû
×î¾ßÈËÆøÈÈÌûÍÆ¼ö [²é¿´È«²¿] ×÷Õß »Ø/¿´ ×îºó·¢±í
[¿¼ÑÐ] 085600²ÄÁÏÓ뻯¹¤349·ÖÇóµ÷¼Á +5 Àîľ×Ó°¡¹þ¹þ 2026-04-12 5/250 2026-04-12 20:10 by bljnqdcc
[¿¼ÑÐ] 2±¾£¬³õÊÔ303£¬0860Çóµ÷¼Á +6 floriea 2026-04-12 8/400 2026-04-12 18:13 by zhouxiaoyu
[¿¼ÑÐ] µ÷¼Á +25 ²»·ê´º 2026-04-07 26/1300 2026-04-12 11:53 by ´óÁ¦Ë®ÊÖÁ¦´óÎÞÇ
[¿¼ÑÐ] 0854µ÷¼Á +12 ³¤¹­°Á 2026-04-09 13/650 2026-04-12 09:56 by ÄæË®³Ë·ç
[¿¼ÑÐ] 307Çóµ÷¼Á +10 tzq94092 2026-04-10 10/500 2026-04-12 08:18 by wise999
[¿¼ÑÐ] 293Çóµ÷¼Á +8 ÓÂÔ¶¿â°®314 2026-04-06 8/400 2026-04-11 20:25 by À¶ÔÆË¼Óê
[¿¼ÑÐ] µ÷¼Á +4 µçÆø300Çóµ÷¼Á²» 2026-04-08 7/350 2026-04-11 10:44 by ×ÏêØ×ÏÆå
[¿¼ÑÐ] 283Çóµ÷¼Á +22 ÄǸöàà×Ó 2026-04-09 22/1100 2026-04-11 10:41 by ÄæË®³Ë·ç
[¿¼ÑÐ] 302·ÖÇóµ÷¼Á +9 ·²ÓïÆíÔ¸ 2026-04-08 10/500 2026-04-10 23:26 by 314126402
[¿¼ÑÐ] 314Çóµ÷¼Á +18 xhhdjdjsjks 2026-04-09 19/950 2026-04-10 18:53 by HPUCZ
[¿¼ÑÐ] ±¾¿ÆÎ÷¹¤´ó 0856 324Çóµ÷¼Á +10 wysyjs25 2026-04-09 11/550 2026-04-10 08:37 by 5268321
[¿¼²©] ²©Ê¿×Ô¼ö +7 ¿É¿ÉСÅÖ 2026-04-08 7/350 2026-04-10 08:28 by kimhero
[¿¼ÑÐ] ÉúÎïѧµ÷¼Á£¬Ò»Ö¾Ô¸Î÷ÄÏ´óѧ348£¬TopÆÚ¿¯Ò»Çø¶þ×÷¡¢¶þÇøÈý×÷£¬ÈýµÈ½±Ñ§½ðÈý´Î +4 candyyyi 2026-04-09 4/200 2026-04-09 18:39 by l_paradox
[¿¼ÑÐ] ²ÄÁϵ÷¼Á +10 18815505510 2026-04-09 11/550 2026-04-09 17:07 by 544594351
[¿¼ÑÐ] 328Çóµ÷¼Á +17 lftmya 2026-04-07 18/900 2026-04-09 08:05 by 5268321
[¿¼ÑÐ] 327Çóµ÷¼Á +10 Xxjc1107. 2026-04-06 11/550 2026-04-09 01:21 by lature00
[¿¼ÑÐ] ²ÄÁÏ¿¼ÑÐÇóµ÷¼Á×Ü·Ö280 +30 mkjlz1 2026-04-06 35/1750 2026-04-08 21:25 by cyh¡ª315
[¿¼ÑÐ] 266µ÷¼Á +8 daya sun 2026-04-07 9/450 2026-04-08 20:27 by yutian743
[¿¼ÑÐ] ±¾¿ÆÉúÎïÐÅϢѧ£¬×Ü·Ö362 Çó07 08µ÷¼Á +6 qСٻ1210 2026-04-06 6/300 2026-04-07 19:40 by macy2011
[¿¼ÑÐ] ÉúÎïѧѧ˶Çóµ÷¼Á£º351·ÖÒ»Ö¾Ô¸ÄϾ©Ê¦·¶´óѧÉúÎïѧרҵ +6 ¡­¡«¡¢Íõ¡­¡« 2026-04-06 7/350 2026-04-06 18:54 by macy2011
ÐÅÏ¢Ìáʾ
ÇëÌî´¦ÀíÒâ¼û