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[热点] 各位基础老师们，看完中央《从严治党》的决定后，对学术界更加有信心了吧 iaeyuan 2026-11-04 刚刚
[MS] [已完结]在MS中如何建一个含有200个小分子的盒子 (1/846) xinji 2011-08-24 2011-08-25 13:24:08 by wzbhit
[LAMMPS/ ] [已完结][关贴]用DL-POLY模拟水合物生成 (2/931) 高学剑 2011-05-16 2011-08-25 11:51:41 by zyj8119
[MS] [已完结]请问下图的介观结构是如何构建出来的？ (评阅+1) (4/1524) jolly1987 2011-08-23 2011-08-25 09:43:26 by zyj8119
[MS] [已完结]问个气体吸附的基础问题，大家看看 (6/1249) rdw00 2011-08-03 2011-08-24 22:19:07 by niliu
[LAMMPS/ ] [已完结]表面弛豫 (0/549) 上官七七 2011-08-24 2011-08-24 21:36:16 by 上官七七
[LAMMPS/ ] [已完结]用LJ模拟裂纹扩展，可是结果出来都是从加力的地方断。。。。求解决啊。。。。 (1/570) 527751273 2011-08-24 2011-08-24 21:24:09 by 527751273
[MS] [已完结]MS模拟结束后，一查看结果，就自动关闭 (2/421) jin9090900 2011-08-23 2011-08-23 22:08:36 by 御剑江湖
[MS] [已完结]关于ideal adsorbed solution theory 问题 (0/1010) 061302102 2011-08-23 2011-08-23 21:52:45 by 061302102
[Monte C ] [已完结]请教水的SPC/E的Monte Carlo模拟的问题。 (2/910) Bessel 2011-08-23 2011-08-23 20:07:01 by yahoohoo
[MS] [已完结]MS安装后运行时出现的问题 (2/1635) xinji 2011-08-22 2011-08-23 19:02:19 by tlger
[MS] [已完结]安装时要输入password 要怎么处理？ (1/684) xinji 2011-08-23 2011-08-23 18:00:32 by wzbhit
[MS] [已完结]MS如何图片处理供发文章用 (1/687) jin9090900 2011-08-23 2011-08-23 17:58:42 by wzbhit
[MS] [已完结]谁知道Discover中Ewald方法处理partial charge用的是什么方法？ (1/484) cougarliu 2011-08-21 2011-08-23 13:58:07 by xiyi1985
[Gromacs ] [已完结]键角力常数怎样算？ (0/698) patent 2011-08-22 2011-08-22 23:00:08 by patent
[MS] [已完结]关于ms版本的问题，在低版本上打不开怎么办？ (2/1119) tlger 2011-08-22 2011-08-22 18:40:51 by tlger
[Gromacs ] [已完结][关贴]加上一个特定值 (0/183) memgr 2011-08-22 2011-08-22 11:31:19 by memgr
[LAMMPS/ ] [已完结][关贴]win server 2003下lammps的并行安装问题 (0/1380) hedonistful 2011-08-22 2011-08-22 09:33:35 by hedonistful
[MS] [已完结]径向分布函数如此之大 (评阅+1) (7/2126) chenxiankai 2011-05-12 2011-08-21 10:36:13 by 文子526
[DS/Syby ] [已完结]在ubantu下安装autodock不成功，求助！ (0/623) zhaoyichem 2011-08-20 2011-08-20 13:21:04 by zhaoyichem
[MS] [已完结]请问这种结构式用什么软件得到的 (3/871) 文子526 2011-08-20 2011-08-20 11:04:20 by ahehyh
[MS] [已完结]ms5.0 安装时自定义模块问题 (3/899) tlger 2011-08-18 2011-08-20 10:20:06 by wzbhit
[Gromacs ] [已完结]结合自由能计算出错 (0/274) ww5945 2011-08-19 2011-08-19 22:03:32 by ww5945
[MS] [已完结]帮忙下一个NaA分子筛的资料或结构，有网址 (2/462) jmlyh666 2011-06-26 2011-08-19 21:45:00 by alphawei
[DS/Syby ] [已完结]DS的溶剂可及面积以及其他    ( 1 2 ) (12/2007) lizzie_su 2011-08-16 2011-08-19 16:41:51 by chemozhang
[LAMMPS/ ] [已完结]lammps菜鸟，请问这是出的什么问题？ (0/310) 527751273 2011-08-19 2011-08-19 16:22:15 by 527751273
[其他] [已完结]求助：谁会傅里叶变换图 (8/2238) zhang727626 2011-08-11 2011-08-19 11:52:45 by tsiangsun
[DS/Syby ] [已完结][关贴]求助用DS进行同源建模的高手 (2/1044) qingtingzhe 2011-08-16 2011-08-18 21:05:52 by qingtingzhe
[MS] [已完结]纳米线动力学模拟 (0/219) tonghuadream 2011-08-18 2011-08-18 19:16:51 by tonghuadream
[MS] [已完结]有没有方法让ms打开时不跳窗口 (1/543) tlger 2011-08-18 2011-08-18 18:23:31 by wzbhit
[MS] [已完结]纳米薄膜摩擦问题 (4/909) jdnfine 2011-08-15 2011-08-18 16:42:23 by jdnfine
[Gromacs ] [已完结]NAMD中二面角参数中的多重度n怎么确定 (1/484) gezhenpeng 2011-08-14 2011-08-16 15:39:32 by liqingwen
[MS] [已完结]求助discover模块资料 (1/552) 零星 2011-08-15 2011-08-16 11:58:23 by lhllookatme
[其他] [已完结]求助 我的脚本运行不了，求高手指点 (1/445) leon583520 2011-08-15 2011-08-15 22:06:18 by leon583520
[Gromacs ] [已完结]GROMACS语言 (0/666) liuyusuc 2011-08-15 2011-08-15 19:46:17 by liuyusuc
[其他] [已完结]门外汉提问 (3/456) lizzie_su 2011-08-15 2011-08-15 19:09:55 by yalefield
[DS/Syby ] [已完结][关贴]dicovery studio 2.5 licence password (5/2271) qingtingzhe 2011-08-13 2011-08-15 15:18:13 by chemozhang
[Gromacs ] [已完结]tip5p水分子与自定义原子的L-J参数构造与压力控制等问题 (0/1692) maad 2011-08-15 2011-08-15 11:04:48 by maad
[MS] [已完结]轨道问题 (2/686) zhangyanbin858 2011-08-14 2011-08-15 10:45:02 by tianbing67
[MS] [已完结]关于discover模块中dynamics模拟时间问题 (1/364) tlger 2011-08-14 2011-08-15 08:27:02 by wzbhit
[MS] [已完结]tinker程序使用 (3/729) liuyusuc 2011-08-03 2011-08-14 11:08:52 by fcenf
[MS] [已完结]有CCDC的虫子帮忙查一下二钛酸钾的晶体数据 (2/356) badercao 2011-08-12 2011-08-14 08:04:38 by badercao
[MS] [已完结]分子模拟的原理问题 (5/900) liuyusuc 2011-08-09 2011-08-13 17:44:28 by liuyusuc
[其他] [已完结]有没有生成FCC结构的fortran程序？ (0/262) hxm1989 2011-08-12 2011-08-12 20:58:10 by hxm1989
[MS] [已完结]NVT平衡问题 (评阅+1) (5/2586) 笑问天 2011-07-10 2011-08-12 20:41:59 by tsiangsun
[MS] [已完结]density profile如何得到 (模拟EPI+1)(2/1150) tlger 2011-08-12 2011-08-12 20:30:58 by 527751273
[MS] [已完结]如何计算分子的gibbs自由能 (0/601) xiaocuicui 2011-08-12 2011-08-12 17:24:02 by xiaocuicui
[MS] [已完结]dmol3中的小问题 (1/477) 604179362 2011-06-27 2011-08-12 17:06:25 by cenwanglai
[Gromacs ] [已完结][关贴]谁会compile namd2.8？ (0/229) superdirac 2011-08-11 2011-08-11 21:04:18 by superdirac
[DS/Syby ] [已完结][关贴]急！autodock无法运行，提示can't find receptor_rigid.map.fld (0/1349) hebeilibing1 2011-08-11 2011-08-11 13:51:17 by hebeilibing1
[DS/Syby ] [已完结]LIBDOCK 虚拟筛选 操作问题 (1/414) 绿茶QJM 2011-08-08 2011-08-09 16:02:10 by 绿茶QJM
[DS/Syby ] [已完结]Autodock怎么处理含有许多model的大分子？ (2/945) ranzo67 2011-08-09 2011-08-09 14:53:37 by chemozhang
[其他] [已完结]哪里能下载到Thomas-fermi-dirac的分子动力学程序 (0/282) ikea1984 2011-08-09 2011-08-09 02:25:36 by ikea1984
[Monte C ] [已完结]请问硕士文章应该投稿到哪种核心期刊？ (5/2413) zhuna325 2011-08-05 2011-08-08 14:35:59 by 御剑江湖
[Monte C ] [已完结]如何定义扭转检测器？ (3/577) 咖啡喝不醉 2011-08-06 2011-08-08 12:17:56 by 咖啡喝不醉
[MS] [已完结]pdb中性双重态自由基的情况！ (0/347) liuyusuc 2011-08-06 2011-08-06 12:43:41 by liuyusuc
[MS] [已完结]Discover 中动力学模拟总是达不到指定步数 (3/898) njust05 2011-07-24 2011-08-06 10:32:33 by 咖啡喝不醉
[MS] [已完结][关贴]MS 导入ICSD 晶体参数后 MS模型不正确。 (3/708) o58285880 2011-06-15 2011-08-05 16:25:35 by 水之源
[MS] [已完结]用tinker的amoeba09力场模拟~~总是提示参数未定义~~~怎么办啊~热切求助 (评阅+1) (模拟EPI+1)(7/2657) plafalines 2011-05-03 2011-08-05 05:04:20 by ChemiAndy
[Gromacs ] [已完结]关于审稿人的意见，请大家帮忙。着急。。。。。 (4/1701) tpp001 2011-06-14 2011-08-05 02:11:20 by zhaoliang_fly
[其他] [已完结]作者没回复，怎么办？ (3/497) liqingwen 2011-07-26 2011-08-04 17:28:22 by liqingwen
[Gromacs ] [已完结]新手想知道如何用Amber做蛋白质分子固定某两个或多个氨基酸距离的MD计算 (模拟EPI+1)(4/2166) jackyma 2011-06-28 2011-08-04 14:50:55 by jackyma
[MS] [已完结]请教NaA分子筛骨架结构的搭建？ (8/1919) 061302102 2011-04-19 2011-08-04 09:46:59 by 061302102
[其他] [已完结]急求文献！！！ (1/304) guoman2006 2011-08-03 2011-08-03 16:07:12 by guoman2006
[MS] [已完结][关贴]谁给发个 《分子模拟基础》 江元生院士版的啊？ (0/320) 虫尾巴 2011-08-03 2011-08-03 10:43:11 by 虫尾巴
[MS] [已完结]Random Copolymer中Propagate using内两个合成方法的参数设置 (0/309) wangrunkm 2011-08-03 2011-08-03 10:01:55 by wangrunkm
[MS] [已完结]获得pdb文件的源文件 (3/1373) liuyusuc 2011-08-01 2011-08-01 18:36:45 by yalefield
[Gromacs ] [已完结]每次用gromacs在进行pr时都会出现fatal error，求解 (评阅+2) (4/1802) syd89522 2011-07-15 2011-08-01 16:14:17 by syd89522
[MS] [已完结]蛋白质活性腔大小分析 (1/523) zxl102623 2011-08-01 2011-08-01 14:44:23 by q1036210267
[Gromacs ] [已完结]氨基酸的密度 (5/1462) liuyusuc 2011-07-26 2011-08-01 12:06:39 by liuyusuc
[MS] [已完结]耗散粒子动力学 (9/2659) liuyusuc 2011-07-22 2011-07-30 14:19:25 by yahoohoo
[其他] [已完结]计算第一超极化率时是否需要单位换算 (0/613) 杨学舜 2011-07-30 2011-07-30 13:35:17 by 杨学舜
[其他] [已完结]蛋白三维结构对比分析 (0/517) yzm3102001 2011-07-27 2011-07-27 09:19:59 by yzm3102001
[DS/Syby ] [已完结]交叉验证相关系数q方和相关系数R方    ( 1 2 ) (14/4353) 家强 2011-07-12 2011-07-26 21:15:56 by bbslover
[MS] [已完结]晶体与溶剂的相互作用能 (4/691) jjgao5 2011-06-29 2011-07-26 19:24:19 by zjj760120
[其他] [已完结]模拟非均相体系时如何评价力场的准确性？ (1/379) vigaryang 2011-07-25 2011-07-26 07:11:00 by piaoma
[MS] [已完结]discover错误提示 (1/730) 叶筱晴 2011-06-17 2011-07-25 15:15:52 by crystalzxz
[ME/Gulp] [已完结]装的GULP 哪去啦？ (8/1570) 夏目铃子 2011-07-20 2011-07-25 11:53:59 by w76990480
[DS/Syby ] [已完结]急求sybyl-x window软件！ (3/910) PSA 2011-07-22 2011-07-25 08:47:26 by PSA
[其他] [已完结][关贴]分子立体构象二面角查看 (0/455) swustxxl 2011-07-24 2011-07-24 10:31:53 by swustxxl
[DS/Syby ] [已完结]在sybyl-x中如何优化小分子，生成.SLN文件 (2/1399) shouling 2011-07-19 2011-07-23 23:26:38 by chemozhang
[DS/Syby ] [已完结]在sybyl-x中如何将.mdb文件夹变成.hist文件 (2/991) shouling 2011-07-23 2011-07-23 23:20:53 by chemozhang
[Monte C ] [已完结]如何使用towhee软件，谁有相关教程？ (0/919) xinji 2011-07-23 2011-07-23 11:36:47 by xinji
[DS/Syby ] [已完结]Chem 3D中构建2个手性中心的小分子 (0/1146) zsla380 2011-07-23 2011-07-23 10:57:16 by zsla380
[MS] [已完结]溶度参数 (0/260) liuyusuc 2011-07-22 2011-07-22 19:23:24 by liuyusuc
[其他] [已完结]请问这个用什么软件可以画出来 (3/1173) tigerzxt 2011-07-21 2011-07-22 10:43:25 by wwt1806
[DS/Syby ] [已完结]win7旗舰版装DS出现问题 (7/2789) cecilia533 2011-05-03 2011-07-20 23:22:01 by chemozhang
[MS] [已完结]discover 模块不能优化 (5/1495) qiaobo 2011-07-06 2011-07-20 23:17:27 by fyy0210
[MS] [已完结]Amorphous Cell 中Construction 一个分子为什么Add成两个？ (1/460) njust05 2011-07-20 2011-07-20 12:20:00 by njust05
[MS] [已完结]求助：MS中如何找几何中心 (0/1259) zhang727626 2011-07-20 2011-07-20 09:47:20 by zhang727626
[Monte C ] [已完结][关贴]蒙特卡罗模拟汽液、液液的相平衡 (2/530) kecy 2011-07-19 2011-07-19 17:11:40 by ghcacj
[ME/Gulp] [已完结]求教程 (1/722) 朱雪婷 2011-05-06 2011-07-19 09:11:57 by 望月秦淮
[已完结]查找文献 (0/142) wangyudany 2011-07-18 2011-07-18 10:21:53 by wangyudany
[其他] [已完结]在chem 3D 中测量分子长度！ (0/1525) ryan999 2011-07-18 2011-07-18 00:43:30 by ryan999
[Gromacs ] [已完结]Gromacs 中 PME 的用法 (5/2372) ruthxu 2011-07-14 2011-07-17 09:53:03 by ruthxu
[LAMMPS/ ] [已完结]DL_POLY中rdf的参数设置 (2/586) 高学剑 2011-04-22 2011-07-17 08:30:41 by 高学剑
[已完结][关贴]量化新手求解答 (0/205) kidd1986 2011-07-16 2011-07-16 21:54:24 by kidd1986
[MS] [已完结][关贴]求Tf2N的key文件 (0/197) zxl523 2011-07-16 2011-07-16 18:15:06 by zxl523
[DS/Syby ] [已完结]autodock生成dlg文件的时候出现的错误。要怎么修改参数 (0/1486) wqx1990 2011-07-15 2011-07-15 22:38:21 by wqx1990
[LAMMPS/ ] [已完结]有关用md做mofs材料吸附动力学的问题 (1/840) ldf831206 2011-04-19 2011-07-15 20:12:39 by huanghl2010
[其他] [已完结]初始温度对模拟结果的影响 (1/657) kelly612 2011-07-13 2011-07-15 11:20:53 by gavinliu7390
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