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[热点] 越来越担心硕士毕业后没有竞争力了 zuesli 2026-10-28 刚刚
[Gromacs ] [已完结]amber MD过程中出现的问题 求各位大神解答 (7/2218) lingogo 2013-03-08 2015-01-22 12:51:51 by therotyonth
[Gromacs ] [已完结]求质心,粗粒化后的参数获取    ( 1 2 ) (10/2826) Leliel 2013-07-30 2015-01-22 12:50:58 by guyun007
[DS/Syby ] [已完结]薛定谔glide板块中对于配体的优化 (0/878) 脱掉的夏 2015-01-22 2015-01-22 10:53:12 by 脱掉的夏
[MS] [已完结]二氧化硅晶体cleave plane问题    ( 1 2 ) (评阅+1) (17/3167) 吉米爱多 2015-01-20 2015-01-22 09:02:21 by 吉米爱多
[专家会诊] [已完结][关贴]求教 对solid state 的能量最小化,structure relaxation (评阅+1) (0/345) xujun16 2015-01-22 2015-01-22 00:45:54 by xujun16
[MS] [已完结]奇怪!win7下MS7.0闭后就无法重连linux计算服务器了 (1/464) sandf 2015-01-21 2015-01-21 19:01:15 by sandf
[MS] [已完结]求助 MS中discover模块中建模的问题    ( 1 2 ) (12/2301) dolphin_star 2012-12-13 2015-01-21 17:30:46 by czj1019
[LAMMPS/ ] [已完结]pair_coeff中的截断半径问题求助, (0/999) 数峰青820 2015-01-21 2015-01-21 17:25:25 by 数峰青820
[MS] [已完结][关贴]MS提交过渡态搜索时提示“Please ensure that a trajectory document is active” (评阅+1) (5/1236) hongsemenghuan 2015-01-16 2015-01-21 15:38:33 by hongsemenghuan
[MS] [已完结][关贴]产物与反应物建立过渡态结构的问题 (评阅+1) (2/1084) 飞的genggao 2015-01-18 2015-01-21 15:15:13 by 飞的genggao
[MS] [已完结]MS算氢键以后怎么算能量 (2/1415) huoqilin01 2014-09-15 2015-01-21 13:34:10 by 小双423
[LAMMPS/ ] [已完结][关贴]求graphene indentation的in文件,重金悬赏 (评阅+1) (0/275) 学员C3FP9l 2015-01-21 2015-01-21 13:04:27 by 卫兵gwb
[MS] [已完结]服务器提交MS作业,为什么得不到能量图(SimulationEnergies.xcd )? (6/1317) voleyes 2011-12-13 2015-01-21 13:03:56 by yuyanpiaoxue
[MS] [已完结]forcite 进行径向分布函数分析 (4/2529) haiyuntianya 2015-01-19 2015-01-21 11:25:58 by congtaiupc
[MS] [已完结]分子孔道大小对气体自扩散系数有什么影响? (评阅+1) (0/531) aa2349439 2015-01-21 2015-01-21 10:53:38 by aa2349439
[MS] MS中的高斯板块怎么画HOMO图? (0/938) nana5281 2015-01-21 2015-01-21 10:20:06 by nana5281
[LAMMPS/ ] 【讨论】求教:data和input文件都能含有的输入内容 (4/1367) boowood 2010-03-05 2015-01-21 09:28:43 by bmnce
[MS] [已完结]【作图】 分子筛主要孔道走向图的画法 (评阅+1) (3/2254) lusostty 2015-01-19 2015-01-21 08:27:24 by lusostty
[MS] [已完结]模拟后蛋白分析问题 (评阅+6) (1/393) 小丫丫——— 2014-03-09 2015-01-21 07:40:42 by 229231168
[DS/Syby ] [已完结]GLOD分子模拟结果分析和参数设置 (0/549) lyxdjdj 2015-01-20 2015-01-20 23:02:48 by lyxdjdj
[Gromacs ] [已完结]Gromacs 做教程1 水中溶菌酶时,npt压力不是1个大气压。 (2/1314) guoxinw 2015-01-02 2015-01-20 15:11:53 by awaken2013
[MS] [已完结]求助找一篇文献:Algorithms for brownian dynamics (2/435) fannieyang 2015-01-20 2015-01-20 09:02:47 by liaobuqi138
[资源] [已完结]求多肽同源建模的相关文献 多肽能不能像蛋白质一样同源建模呢 (评阅+1) (1/1013) cheor3war 2015-01-19 2015-01-20 00:23:38 by awaken2013
[LAMMPS/ ] [已完结]分子 (评阅+1) (0/260) zdyhbz 2015-01-19 2015-01-19 14:10:03 by zdyhbz
[MS] [已完结]【求助】重装ms后依然有这个问题,求虫友们友情帮忙~ (3/493) 809011916 2014-12-15 2015-01-19 13:43:21 by 809011916
[DS/Syby ] [已完结]求问几个autodock的问题,蛋白质和小分子的对接 (评阅+1) (7/3288) 空的天 2015-01-16 2015-01-19 12:05:11 by 晔?�
[MS] [已完结]求助:计算MM_PBSA的问题 (评阅+1) (0/308) anran19888 2015-01-19 2015-01-19 11:09:24 by anran19888
[MS] [已完结]如何判断一个化学键是否穿过一个苯环或者原子形成的其他环 (评阅+1) (5/1995) winnds 2015-01-17 2015-01-19 09:14:02 by pigrass
[Gromacs ] [已完结]VMD 统计某个分子周围水分子数目随时间的变化 (9/4718) xiaoyingw 2011-10-18 2015-01-19 08:13:35 by xwwjd
[专家会诊] [已完结]稀薄气体及其与液面相互作用问题-那款MD软件好? (1/561) stones_me 2012-12-05 2015-01-19 08:07:45 by nmzld
[其他] [已完结]去哪可以查到分子的范德华直径? (评阅+1) (2/1856) 1028942887 2015-01-18 2015-01-18 16:21:04 by 1028942887
[Gromacs ] [已完结]有关计算MMPBSA的问题 (评阅+1) (0/603) anran19888 2015-01-18 2015-01-18 16:12:33 by anran19888
[LAMMPS/ ] [已完结]NPT动力学之后出现负压 (评阅+1) (2/1362) Materialman 2015-01-12 2015-01-18 06:36:31 by abinitio
[Gromacs ] [已完结]请问做胶束分子模拟的时候,那些立场参数都是从哪里得来的呢? (1/312) 白玉浴血 2014-12-18 2015-01-17 22:20:28 by 231645
[其他] [已完结]分子模拟基础学习方法 (评阅+1) (3/861) 小蜜蜂会叮人 2014-11-28 2015-01-17 22:10:23 by 231645
[MS] [已完结]morphology模块 (评阅+1) (2/860) 董倩倩 2015-01-17 2015-01-17 15:02:01 by 董倩倩
[Gromacs ] 分子模拟时间越长越好吗? (评阅+1) (模拟EPI+9)(44/18752) 奋斗1s 2011-06-30 2015-01-17 06:27:24 by 背包旅客
[LAMMPS/ ] 新手请问下图代表什么意思 (评阅+1) (0/353) bmnce 2015-01-16 2015-01-16 18:52:53 by bmnce
[MS] [已完结]怎样得到吸附结构的分子密度分布曲线 (评阅+1) (9/3226) wangfei天空 2015-01-15 2015-01-16 16:23:32 by pigrass
[MS] [已完结][关贴]建模的时候如何删除,重叠的多余原子 (评阅+1) (1/2319) 山谷幽壑 2015-01-16 2015-01-16 14:49:17 by zsjan
[LAMMPS/ ] 弛豫中的运动 (3/676) ysshj 2014-09-15 2015-01-16 13:51:10 by ysshj
[Gromacs ] 【求助】怎样才能使整个盒子充满水,用gromacs (6/3614) patent 2011-03-09 2015-01-16 12:33:20 by 背包旅客
[MS] [已完结]高斯画出的构型能用MS优化吗? (评阅+1) (0/728) 徐建昌老二 2015-01-16 2015-01-16 11:34:37 by 徐建昌老二
[MS] 请问怎么用MS构建不同湿度的聚乙烯醇模型? (2/995) 世媛ROSE 2015-01-15 2015-01-16 09:14:02 by 赵红霞
[LAMMPS/ ] [已完结]用Lammps模拟HAP(hydroxyapatite)晶体 (2/916) kimi838 2013-08-22 2015-01-16 08:14:03 by 嗜竹情深
[Gromacs ] [已完结]分子动力学模拟“边界问题”含义    ( 1 2 ) (评阅+1) (10/3849) lmyiop 2014-03-01 2015-01-16 08:11:02 by 菜菜瓜瓜虫虫
[其他] [已完结]pymol6-芳环质心距离的画法,请求详细介绍步骤方法 (评阅+1) (0/1759) tianpingpe 2015-01-16 2015-01-16 00:54:52 by tianpingpe
[MS] [已完结]如何在MS的三维界面上画出一个圆柱形状的区域啊? (评阅+1) (4/1721) 长大小慧慧 2014-12-15 2015-01-15 17:12:44 by upc穆宁
[资源] 量子化学研究网站 (评阅+1) (0/513) miaoskypop 2015-01-15 2015-01-15 14:53:41 by miaoskypop
[MS] [已完结]求助NaA(4A)和CaA(5A)分子筛的晶胞结构 (评阅+1) (3/1513) 故事是这样的 2015-01-14 2015-01-15 09:10:55 by 故事是这样的
[LAMMPS/ ] lammps新手如何看手册的 (评阅+1) (0/861) bmnce 2015-01-14 2015-01-14 17:55:45 by bmnce
[Gromacs ] [已完结]gromacs pull的问题!10金币 (评阅+6) (7/1911) 3115321 2013-12-11 2015-01-14 12:06:55 by wpl324
[MS] [已完结]高分子聚二乙烯苯建模 (评阅+1) (7/1581) iljosie 2015-01-12 2015-01-14 11:17:26 by iljosie
[其他] [已完结]amber分子动力学模拟 (评阅+1) (0/768) 菲同寻常 2015-01-14 2015-01-14 09:53:53 by 菲同寻常
[其他] 【求助】全交联(非线型交联)高分子链如何模拟? (1/643) lifenliu 2010-05-06 2015-01-14 07:31:08 by iljosie
[MS] [已完结]Materials Studio 7.0 计算PGA(一种高分子)密度,最终目的期望得到好的PGA分子结构 (评阅+1) (2/1930) oudegeshen 2015-01-09 2015-01-14 00:53:48 by xuyihan
[LAMMPS/ ] [已完结]石墨烯纳米带只有一层原子,该如何定义其抗弯强度或拉伸强度? (评阅+1) (1/906) fqwacf 2015-01-06 2015-01-13 22:26:56 by luzihen
[MS] [已完结]请教采用forcite模块优化晶胞参数后,与实验值相比相差太大(偏差超过5%),怎么办! (评阅+1) (2/1620) 痴迷书童 2015-01-10 2015-01-13 22:24:25 by luzihen
[其他] [已完结][关贴]求助 VMware-workstation-full-10.0.1-1379776的序列码。 (评阅+1) (3/1055) 992648352 2014-07-19 2015-01-13 20:40:24 by 992648352
[Monte C ] [已完结][关贴]music计算pmap出问题 (4/1036) willowei 2013-08-03 2015-01-13 17:58:17 by laufe
[Gromacs ] [已完结]关于MS和GROMACS文件转换的问题 (评阅+1) (8/2664) 孜孜-- 2014-09-15 2015-01-13 16:39:40 by georgexuz
[MS] [已完结]MS软件对水分子氢键数目的模拟用哪个模块 (评阅+5) (2/1021) wwwxhr 2013-11-04 2015-01-13 15:28:11 by wangjing1083
[MS] 模拟载荷作用下晶体材料晶粒受载变化的仿真软件,请大家推荐下,谢谢 (评阅+1) (0/374) sohu820528 2015-01-13 2015-01-13 14:49:19 by sohu820528
[MS] Materials.Studio.v6.0使用,谢谢了,谢谢,,    ( 1 2 ) (评阅+1) (10/2620) 笑miA 2015-01-12 2015-01-13 14:06:56 by 笑miA
[MS] 有没有安装过MS7.0的,MS7.0能加外界压力吗?急求助。 (评阅+1) (1/766) laiyangcc 2015-01-13 2015-01-13 12:29:59 by njuedu007
[MS] [已完结]谁会做分子动力学模拟? (评阅+1) (2/964) zhjgl1980 2015-01-12 2015-01-13 11:18:32 by chuntao118
[专家会诊] [已完结]求教回转半径和末端距的模拟细节 (评阅+1) (6/1847) diaobk 2015-01-12 2015-01-13 11:16:49 by chuntao118
[MS] [已完结][关贴]运用蒙托卡罗方法计算吸附时,如何设置单原子模型,求指教 (评阅+1) (0/416) 382124153 2015-01-13 2015-01-13 09:05:37 by 382124153
[LAMMPS/ ] [已完结]lammps如何计算transverse current correlation function (评阅+1) (1/857) JackieXiao 2015-01-12 2015-01-13 07:48:07 by abinitio
[MS] [已完结]amber 中QM/MM模块的处理 (评阅+1) (0/520) tanshepei 2015-01-12 2015-01-12 17:30:51 by tanshepei
[LAMMPS/ ] [已完结]lammps内部建模金属晶体,导入vmd中为什么没有金属键 (评阅+1) (1/1381) fei5122917 2014-12-29 2015-01-12 16:01:35 by 宝儿fan
[MS] [已完结]散尽金币!跪求MS建立水分子晶胞的详细过程! (评阅+1) (6/2257) 蔡元浩 2014-09-16 2015-01-12 11:51:36 by georgexuz
[MS] [已完结]MS 64位运算 (评阅+1) (5/1151) dreamfly_ykf 2015-01-09 2015-01-12 11:47:59 by njuedu007
[Monte C ] [已完结]MUSIC痕量水怎么处理 (评阅+1) (1/630) xu0993 2015-01-09 2015-01-12 09:21:20 by xu0993
[LAMMPS/ ] [已完结][关贴]求indent例子的原文件 (评阅+1) (1/1085) 学员C3FP9l 2015-01-10 2015-01-12 08:27:08 by abinitio
[MS] [已完结]分子筛晶胞和原包之间的转换 (1/502) premonkey 2012-03-15 2015-01-12 08:24:50 by 石勤
[MS] [已完结]DPD粗粒化模型构建 (评阅+1) (0/664) lrlws 2015-01-10 2015-01-10 22:13:38 by lrlws
[DS/Syby ] [已完结]模拟化合物分子与金属离子螯合作用 (评阅+1) (0/645) jhonsmith001 2015-01-10 2015-01-10 20:44:58 by jhonsmith001
[LAMMPS/ ] [已完结]怎样去计算两个group里 任意两个原子之间的作用力吗 (评阅+1) (3/2037) z654023015 2014-12-12 2015-01-10 20:39:02 by onion2440
[Gromacs ] [已完结]求助gromacs高手~~~急!Orz~    ( 1 2 ) (评阅+1) (12/2276) 笨笨猫123 2015-01-07 2015-01-10 13:19:46 by awaken2013
[Monte C ] [已完结]蛋白质分子体积的计算 (评阅+1) (2/1787) caizhongyu 2015-01-10 2015-01-10 11:27:22 by caizhongyu
[MS] [已完结]MS软件打开过程中自动关闭 (评阅+1) (0/605) 芝麻小迪 2015-01-09 2015-01-09 23:00:47 by 芝麻小迪
[DS/Syby ] [已完结]DS2.5安装求助 (0/544) well9103 2015-01-09 2015-01-09 16:40:44 by well9103
[专家会诊] [已完结]为什么compassII力场没有铝离子 (评阅+1) (0/2216) 15216105346 2015-01-09 2015-01-09 13:20:09 by 15216105346
[ME/Gulp] [已完结]gulp拟合分子力场,怎样确定力场参数 (评阅+1) (0/1512) vicky21as 2015-01-09 2015-01-09 11:44:10 by vicky21as
[MS] 均方位移求扩散系数 (评阅+1) (2/3835) 世媛ROSE 2015-01-05 2015-01-09 10:45:03 by 月只蓝
[Gromacs ] Ubuntu 下自动安装gromacs (11/4998) 奋斗1s 2011-05-30 2015-01-09 10:25:42 by 刚果红
[专家会诊] [已完结]这怎么和常识有冲突?(Gaussian算出来的和常识有差别) (评阅+1) (1/478) 淼淼逆天 2015-01-07 2015-01-09 10:02:32 by 淼淼逆天
[MS] 构造聚合物    ( 1 2 3 ) (评阅+1) (20/1809) 世外人yww 2014-10-23 2015-01-09 08:11:28 by 呀呀杨会苗
[LAMMPS/ ] [已完结]用Lammps模拟计算水的密度    ( 1 2 ) (评阅+1) (10/6164) huachao90 2014-08-20 2015-01-09 07:06:24 by alwynwen
[MS] [已完结]MS7.0并行效率很低如何处理 (评阅+1) (3/986) youyno 2015-01-08 2015-01-09 04:07:58 by smutao
[MS] [已完结]交联聚合物构建cell时总是提示带电超过默认的0.1 (评阅+1) (0/351) xyujn 2015-01-08 2015-01-08 22:26:21 by xyujn
[Monte C ] [已完结]作MOF的蒙特卡罗模拟吸附小分子时CIF文件有无序结构时如何处理 (评阅+1) (2/990) youyno 2015-01-08 2015-01-08 22:02:39 by 382124153
[DS/Syby ] [已完结]Discovery studio怎么安装 (评阅+1) (0/688) well9103 2015-01-08 2015-01-08 16:32:23 by well9103
[MS] [已完结][关贴]ms添加静电场单位 (评阅+1) (0/1436) xb490284223 2015-01-08 2015-01-08 16:00:12 by xb490284223
[Gromacs ] amber计算中,对对象做SMD以后,如何表示配体周围的水密度变化 (9/1931) 白云鹤TJY 2013-08-23 2015-01-08 12:57:44 by keke_1210
[其他] [已完结][关贴]求四水碳酸镧的cif晶体结构 (评阅+1) (2/1279) chinaworm 2014-05-25 2015-01-08 11:35:52 by 娜写年华1089
[MS] 求解释 (评阅+1) (0/334) 799778539 2015-01-08 2015-01-08 09:25:29 by 799778539
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