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[热点] 博士延得我，科研能力直往上蹿 偏振片 2026-02-05 刚刚
[Gromacs ] [已完结]Amber 可以并行计算吗？ (2/648) vallen 2011-07-13 2011-07-14 18:41:38 by gromacs
[Gromacs ] 关键词求助 (0/201) licaiqin 2011-07-14 2011-07-14 11:38:01 by licaiqin
[Gromacs ] GROMACS ： 把两个*.top文件合并 (1/819) dubo 2011-07-12 2011-07-12 17:19:09 by ben_ladeng
[Gromacs ] [已完结]关于小分子的结构问题 (6/1415) ww5945 2011-07-08 2011-07-12 11:11:36 by dubo
[Gromacs ] [已完结]-- (0/225) 无色无味 2011-07-08 2011-07-08 14:37:08 by 无色无味
[Gromacs ] [已完结]gromacs的脚本运行错误 (1/700) zyj8119 2011-07-05 2011-07-07 10:08:26 by dubo
[Gromacs ] 【求助】这是我安装gromacs过程，但是出错阿，这个怎么办呢？谢谢 (11/3307) xiao_2008 2011-01-20 2011-07-04 17:09:03 by yongma2008
[Gromacs ] [已完结][关贴]gromacs做空间分布函数 (0/273) 0419xuhao 2011-07-04 2011-07-04 10:20:10 by 0419xuhao
[Gromacs ] [已完结]什么原因可能会引起MD时蛋白构象没有变化？ (5/1321) xulinan 2011-06-20 2011-07-04 04:38:23 by hhwinhuanghe
[Gromacs ] 什么叫粒子插入法？ (模拟EPI+1)(5/2228) 0419xuhao 2011-05-10 2011-07-01 16:35:46 by huagai
[Gromacs ] 【分享】VMD User's Guide (评阅+3) (5/650) sinokang 2010-06-08 2011-07-01 12:36:07 by lvchababy
[Gromacs ] 用amber做DNA 的动力学模拟，能否说下你们曾经做过的最长的DNA? (评阅+1) (金币≥8)(16/95) 200699wang 2011-05-30 2011-06-30 11:31:01 by 200699wang
[Gromacs ] [已完结]磷酸根结构的获得及其MD问题 (0/980) xulinan 2011-06-29 2011-06-29 16:31:24 by xulinan
[Gromacs ] [已完结]周期性的问题 (6/645) memgr 2011-06-27 2011-06-29 15:34:27 by memgr
[Gromacs ] [已完结]tau_p应该是多少 (2/640) memgr 2011-06-28 2011-06-29 15:32:55 by memgr
[Gromacs ] [已完结]有关solvateShell的问题 (0/383) 200699wang 2011-06-29 2011-06-29 11:11:35 by 200699wang
[Gromacs ] [已完结]关于HyperChem构建DNA的问题 (金币≥1)(1/42) 200699wang 2011-06-14 2011-06-29 11:01:58 by 200699wang
[Gromacs ] [已完结]AMBER中qm/mm的问题 (评阅+1) (5/1885) 量化新手 2011-06-24 2011-06-29 08:49:33 by 量化新手
[Gromacs ] gromacs空间分布函数的问题 (2/449) sdu_x 2011-06-28 2011-06-28 17:15:17 by sdu_x
[Gromacs ] [已完结]gromacs 计算 binding free energy (模拟EPI+1) (金币≥10)(4/147) jackwangee 2011-05-15 2011-06-26 20:54:33 by jackwangee
[Gromacs ] [已完结]improper项的cosin和harmonic形式的相互转换 (0/413) abin007 2011-06-23 2011-06-23 01:04:07 by abin007
[Gromacs ] 羧酸类物质的分子力场参数如何获得，哪种力场中包含 (0/255) liuyusuc 2011-06-18 2011-06-18 13:04:19 by liuyusuc
[Gromacs ] [已完结]计算两个残基之间的最短距离 (0/1056) shabeir 2011-06-17 2011-06-17 17:34:48 by shabeir
[Gromacs ] [已完结][关贴]mmpbsa出错 (0/255) mengyan142 2011-06-14 2011-06-14 10:02:27 by mengyan142
[Gromacs ] 【求助】psf文件的生成    ( 1 2 ) (19/2967) redhaier 2010-06-04 2011-06-13 14:45:48 by duotojh
[Gromacs ] [已完结]混合溶剂盒子的构建？ (0/758) zhulijuan001 2011-06-13 2011-06-13 09:35:40 by zhulijuan001
[Gromacs ] Gromacs 能量最小化这一步用mdrun就出现Segmentation fault，怎么解决？ (2/1253) zonycyle 2011-06-10 2011-06-13 08:32:47 by zonycyle
[Gromacs ] 用GROMACS如何进行NMA或ENM处理 (评阅+1) (11/1254) wtscrystal 2011-06-09 2011-06-12 20:38:45 by ultraguy
[Gromacs ] [已完结]配体受体MD (评阅+1) (3/895) xulinan 2011-06-08 2011-06-09 11:49:28 by xulinan
[Gromacs ] [已完结]膜蛋白模拟genbox方法 (评阅+1) (1/347) 奋斗1s 2011-06-07 2011-06-08 23:18:34 by 奋斗1s
[Gromacs ] 【求助】求教关于gromacs中qmmethod与qmbasis的问题 (评阅+1) (1/688) come4c 2011-03-15 2011-06-07 21:59:25 by sijifengsd
[Gromacs ] 【求助】求教：gromacs中若有多个QM groups应该如何设置mdp文件？ (评阅+1) (1/657) come4c 2011-03-15 2011-06-07 21:53:52 by sijifengsd
[Gromacs ] 【求助】gromacs下对大分子体系QM/MM计算的问题 (评阅+1) (1/1578) come4c 2011-03-29 2011-06-07 21:46:58 by sijifengsd
[Gromacs ] [已完结]gromacs 中define 讨论 急急急 (0/1035) sichuanemily 2011-06-07 2011-06-07 16:20:42 by sichuanemily
[Gromacs ] 分子动力学经典教材 (1/891) goaliman 2011-06-07 2011-06-07 09:16:59 by wzbhit
[Gromacs ] amber10聚类cluster (4/1488) 夏天的鱼 2011-05-18 2011-06-07 08:48:26 by 夏天的鱼
[Gromacs ] amber10安装 (金币≥500)(5/69) 夏天的鱼 2011-05-17 2011-06-06 09:18:54 by 夏天的鱼
[Gromacs ] [已完结]请问gromacs里计算两个蛋白质的距离的命令是那一个 (4/1174) 20071130055 2011-05-18 2011-06-05 22:53:06 by dubo
[Gromacs ] [已完结]gromacs mdrun时水分子中的原子有问题 (2/1823) xiaoyingw 2011-04-27 2011-06-05 22:49:38 by dubo
[Gromacs ] [已完结]请帮我做下酶的MD (评阅-19) (3/840) 游子8921 2011-06-01 2011-06-05 22:47:35 by dubo
[Gromacs ] [已完结]gromacs使用SMD产生force-time数据如何作图 (评阅+1) (2/1255) fanc232 2011-06-01 2011-06-05 22:45:59 by dubo
[Gromacs ] GBSA能量分解出错 (评阅+1) (1/432) sinokang 2011-06-03 2011-06-05 22:28:38 by dubo
[Gromacs ] [已完结]mmpbsa 出错 (3/787) mengyan142 2011-05-27 2011-06-05 15:38:47 by sinokang
[Gromacs ] [已完结]膜蛋白模拟genbox出错：cannot allocate memory (评阅+1) (1/932) 奋斗1s 2011-06-01 2011-06-01 23:06:51 by 奋斗1s
[Gromacs ] 大家看看这张图是怎么组装的？？先谢谢了 (1/537) nufang19a 2011-05-31 2011-06-01 08:35:58 by wl1258
[Gromacs ] [已完结]gromacs 蛋白优化不成功应该怎样做？ (0/279) sichuanemily 2011-05-31 2011-05-31 19:34:38 by sichuanemily
[Gromacs ] 【求助】有点难度 Too many LINCS warnings (2/2442) dndxwoaini 2011-03-11 2011-05-30 11:36:32 by ldf831206
[Gromacs ] 【求助】跑完MD后，一般都要分析什么东西？ (3/1290) voleyes 2010-06-24 2011-05-27 19:20:39 by lvchababy
[Gromacs ] [已完结]amber 动力学模拟中中DNA太长有什么影响[color=Red]？？？？？[/color] (0/241) 200699wang 2011-05-27 2011-05-27 13:14:16 by 200699wang
[Gromacs ] 【求助】antechamber中遇到的问题    ( 1 2 ) (11/1017) tingjun 2010-06-01 2011-05-27 03:44:39 by fjeld
[Gromacs ] [已完结]能量优化时出错 (评阅+1) (2/1011) Jfreda 2011-05-14 2011-05-25 08:56:23 by 冯慧敏
[Gromacs ] [已完结]怎样使用Amber (1/634) goaliman 2011-05-18 2011-05-24 08:54:41 by 200699wang
[Gromacs ] [已完结]在某一点的自由能 (1/399) shang_shan 2011-05-23 2011-05-24 08:34:29 by 被风掠过
[Gromacs ] [关贴]概率分布“漂移”了怎么办？ (1/823) 明月照清渠 2011-05-23 2011-05-23 20:02:29 by bamboosity
[Gromacs ] [已完结][关贴]从固定MD中提取不同构象跑不固定MD？ (2/542) gxsulong 2011-05-23 2011-05-23 15:36:41 by gxsulong
[Gromacs ] 轨迹文件mdcrd过大，VMD总是出错，有什么解决办法？ (3/1822) xmgign 2011-05-18 2011-05-23 12:20:49 by liqingwen
[Gromacs ] [已完结]Gromacs做steep之后做cg出错 (评阅+1) (5/1303) 奋斗1s 2011-05-17 2011-05-22 23:44:46 by 奋斗1s
[Gromacs ] [已完结]请问用g_dist计算两蛋白间距离 (0/333) 20071130055 2011-05-22 2011-05-22 17:51:37 by 20071130055
[Gromacs ] vmd中怎么算某段蛋白的溶液可及化表面积随模拟时间的变化呢？ (1/597) gjj09 2011-05-21 2011-05-22 13:41:31 by gjj09
[Gromacs ] 水分子在纳米管中，求其氢键与管轴的夹角 (2/824) dndxwoaini 2011-05-05 2011-05-22 10:11:57 by whl2dxl
[Gromacs ] [已完结]请问如何比较碳骨架组的Rg？ (0/463) 20071130055 2011-05-21 2011-05-21 23:47:42 by 20071130055
[Gromacs ] [已完结]请问回旋半径Rg具体指什么？ (0/2717) 20071130055 2011-05-21 2011-05-21 23:44:02 by 20071130055
[Gromacs ] [已完结]g_enery中参数的意义 (2/488) 20071130055 2011-05-20 2011-05-21 12:01:24 by 20071130055
[Gromacs ] [已完结]g_gyrate中参数的意义 (3/1056) 20071130055 2011-05-19 2011-05-20 16:55:28 by gxsulong
[Gromacs ] [已完结]peek_ewald_inpcrd: SHOULD NOT BE HERE是怎么回事？ (金币≥5)(0/23) 200699wang 2011-05-16 2011-05-16 09:17:25 by 200699wang
[Gromacs ] [已完结][关贴]NAMD的能量最小化 (0/960) aquariusy 2011-05-15 2011-05-15 08:42:23 by aquariusy
[Gromacs ] [已完结]三氟乙酸的参数。 (2/523) superdirac 2011-05-13 2011-05-13 16:41:22 by superdirac
[Gromacs ] [已完结]SMD中恒速牵拉和恒力牵拉有什么区别和联系？ (2/969) 200699wang 2011-05-05 2011-05-12 14:37:37 by 200699wang
[Gromacs ] amber中如何加水和乙醇混合溶剂 (0/629) gnli 2011-05-12 2011-05-12 11:02:32 by gnli
[Gromacs ] [已完结][关贴]Amber 力场下的namd轨迹文件能转化为amber轨迹文件吗？ (2/685) 200699wang 2011-05-04 2011-05-11 22:35:04 by 200699wang
[Gromacs ] gromacs 隐式溶剂 (0/1386) xiaoyingw 2011-05-11 2011-05-11 22:05:11 by xiaoyingw
[Gromacs ] [已完结]请教高手讲解Amber安装过程 (模拟EPI+1)(1/500) gnli 2011-05-09 2011-05-09 21:10:10 by ben_ladeng
[Gromacs ] [已完结]谁能提供个Amber的安装程序？ (1/524) gnli 2011-05-06 2011-05-07 07:02:53 by fakeyousb
[Gromacs ] [已完结]amber分子模型模型的构建 (0/560) xiaowuxian 2011-05-06 2011-05-06 10:15:43 by xiaowuxian
[Gromacs ] [已完结]SMD相关问题，好心人哪，你到哪里去了？ (0/266) 200699wang 2011-05-05 2011-05-05 20:15:23 by 200699wang
[Gromacs ] 【求助】关于gromacs安装，mpi安装的时候，总是no timer found，是什么原因？ (评阅+1) (2/417) wdali 2010-12-07 2011-05-05 14:55:50 by 奋斗1s
[Gromacs ] 【讨论】如何指定一个pull 力，但这个力是非谐振变力 (3/381) dndxwoaini 2011-03-25 2011-05-05 09:57:16 by dndxwoaini
[Gromacs ] [已完结]gromacs运行出错 (评阅+1) (3/1409) 奋斗1s 2011-05-04 2011-05-05 09:12:14 by 奋斗1s
[Gromacs ] [已完结]【求助】amber输出文件分析，后缀名不同分别代表什么 (评阅+1) (0/867) 量化新手 2011-05-04 2011-05-04 20:12:11 by 量化新手
[Gromacs ] [已完结][求助]AMBER数据分析问题 (9/1356) 量化新手 2011-04-29 2011-05-03 10:19:03 by 量化新手
[Gromacs ] [已完结]AMBER的并行运算 (1/681) 超人与小木虫 2011-04-28 2011-04-28 22:11:51 by skee2008
[Gromacs ] [已完结]gromacs中的一些问题 (1/473) Jfreda 2011-04-28 2011-04-28 20:10:49 by Jfreda
[Gromacs ] [已完结]哪位有Fe3O4的Top文件 (0/265) smallhawk 2011-04-28 2011-04-28 11:28:22 by smallhawk
[Gromacs ] [已完结]NAMD的SMD中如何加螺旋力 (1/413) sjnyongle 2011-04-26 2011-04-27 20:50:34 by wally8962
[Gromacs ] [已完结]我的蛋白质中有个氨基酸被我人为的乙酰化了,请问这样的蛋白质可以通过Gromacs跑MD吗? (0/477) cy0010 2011-04-26 2011-04-26 17:10:46 by cy0010
[Gromacs ] [已完结]NAMD中怎样求SMD分子的质心坐标    ( 1 2 ) (金币≥80)(12/63) 200699wang 2011-04-20 2011-04-26 14:57:41 by 200699wang
[Gromacs ] groma csdistance restraint (金币≥16)(0/17) 猪猪的宝贝 2011-04-26 2011-04-26 10:50:08 by 猪猪的宝贝
[Gromacs ] 成键能束缚前1/2？ (0/199) kjl3283 2011-04-25 2011-04-25 22:53:34 by kjl3283
[Gromacs ] [已完结]在amber中怎么计算一组原子的中心与另一组原子中心的距离的变化 (0/405) voleyes 2011-04-25 2011-04-25 18:53:08 by voleyes
[Gromacs ] [已完结]gromacs mdrun出错 (0/394) xiaoyingw 2011-04-25 2011-04-25 15:34:54 by xiaoyingw
[Gromacs ] [已完结]参数设置 (2/327) Jfreda 2011-04-24 2011-04-25 09:27:29 by 御剑江湖
[Gromacs ] [已完结]mdp参数设置 (评阅+1) (3/827) Jfreda 2011-04-20 2011-04-23 00:51:02 by whl2dxl
[Gromacs ] 【求助】能加多少水 (1/286) memgr 2011-04-07 2011-04-22 00:24:07 by whl2dxl
[Gromacs ] [已完结]均方末端距 (1/908) memgr 2011-04-21 2011-04-21 21:58:01 by zyj8119
[Gromacs ] [已完结]紧急求助！amber加各向不同厚度溶剂 (0/154) xd200620940 2011-04-21 2011-04-21 18:55:20 by xd200620940
[Gromacs ] [已完结]继续求助gromacs安装-第二期，fftw-3.1.2 (0/399) 奋斗1s 2011-04-21 2011-04-21 13:22:43 by 奋斗1s
[Gromacs ] [已完结]gromacs安装第一期：lam-7.1.3 结果分析 (0/430) 奋斗1s 2011-04-21 2011-04-21 11:29:34 by 奋斗1s
[Gromacs ] 【求助】什么是可及表面积？ (2/458) ruthxu 2011-04-12 2011-04-21 11:13:03 by ts2009
[Gromacs ] 【求助】SMD方向问题 (7/1197) wangyibo20 2009-05-31 2011-04-20 20:00:41 by 200699wang
[Gromacs ] 为什么能量最小化时出现Unit 10 Error on OPEN: refc 的错误提示 (2/1923) xiaowuxian 2011-04-19 2011-04-20 17:40:18 by xiaowuxian
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