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[热点] 售SCI一区T0P文章,我:8.O.55.1.O.5.4,科目全,可+急 pwtWF7Qmx6Jw 2026-11-03 刚刚
[Monte C ] [已完结]towhee 密度的计算 (3/722) 如水.101 2011-11-15 2012-05-05 15:45:32 by zhang_jaj
[Monte C ] 在运行towhee的时候,运行及其缓慢,但是并未停止,请问这是什么情况? (1/824) xinji 2011-07-30 2012-05-05 15:05:51 by zhang_jaj
[Gromacs ] [已完结]求助amber跑酶的MD (0/314) 游子8921 2012-05-05 2012-05-05 10:21:32 by 游子8921
[其他] 【求助】哪个软件比较适合模拟纳米通道中的离子输运现象    ( 1 2 ) (16/3039) snchenge8778 2010-08-22 2012-05-05 07:36:24 by tfl20071306
[Gromacs ] [已完结]如何构建木二糖分子力场 (8/1427) wshzxcc 2012-02-13 2012-05-05 06:52:54 by wshzxcc
[MS] [已完结]xmgrace画图 (0/460) smart824 2012-05-04 2012-05-04 19:53:03 by smart824
[ME/Gulp] [已完结]ME中二维边界条件该怎么设定 (2/762) 上官七七 2011-06-14 2012-05-04 19:14:05 by 木子化十文武
[MS] [已完结]怎样求分子动力学模拟所得xtd的能量! (2/394) wangyiyongwz 2012-05-02 2012-05-04 14:55:23 by wangyiyongwz
[MS] NPT系综高压压缩模拟盒子 (0/772) ghy8879 2012-05-04 2012-05-04 14:42:01 by ghy8879
[LAMMPS/ ] [已完结][关贴]DL_POLY的mxlist参数怎么设置? (0/432) vallen 2012-05-04 2012-05-04 11:49:40 by vallen
[其他] [已完结]丙烷的结构参数(包括C-C和C-H键长及相关键角),麻烦注明出处 (2/4254) abin007 2012-02-26 2012-05-04 08:10:10 by 154552485
[Gromacs ] [已完结]Amber10作业正常提交,但是无".mdcrd"和".rst"结果文件生成 (4/1356) cderic 2012-04-28 2012-05-03 23:08:35 by cderic
[专家会诊] [已完结]复合材料的增强体和基体之间的界面 (4/1869) yhpaid 2012-04-10 2012-05-03 21:36:09 by yhpaid
[MS] [已完结]求大侠指教 (5/690) 水影恋镜 2012-05-02 2012-05-03 19:07:50 by caijj09
[MS] [已完结]MS在模拟高分子构象不对!    ( 1 2 ) (19/2832) wangyiyongwz 2012-04-28 2012-05-03 10:54:52 by Toma
[其他] 【求助】相关函数归一化问题 (评阅-1) (6/1854) astringent 2010-12-07 2012-05-02 19:38:17 by manutdhk
[其他] [已完结]分子模拟的高手们请过来看看! (1/917) pan-ge 2012-05-02 2012-05-02 17:42:39 by pan-ge
[Gromacs ] [已完结]大家帮忙看这个图。。。 (0/568) zhongyunxia 2012-05-02 2012-05-02 15:41:53 by zhongyunxia
[DS/Syby ] [已完结][关贴]小分子对接 (3/748) 家强 2012-04-29 2012-05-02 11:45:36 by 家强
[MS] [已完结]这个图怎么分析?急!!! (1/329) 1026580419 2012-05-02 2012-05-02 10:09:06 by 青菜001
[其他] Schrodinger.Suite.2010-ZWTiSO 药物研究完整解决方案 (8/2689) wtscrystal 2011-04-23 2012-05-02 06:33:15 by nothing3380
[其他] [已完结]比较两种化合物的除草活性,从哪些方面比较? (0/345) hcssky 2012-05-01 2012-05-01 21:06:19 by hcssky
[MS] CASTEP时Energy Change那条线始终不收敛 (2/967) kidxiaoji 2012-05-01 2012-05-01 17:29:07 by chaizhm
[MS] [已完结]discover模拟,分子跑到盒子外面怎么办 (5/2478) mjjwhs 2012-04-28 2012-05-01 14:03:05 by mjjwhs
[MS] [已完结]charge的意义 高分求解 (5/2476) hjfdgg 2012-04-28 2012-05-01 00:22:14 by pumpkin_sky
[其他] [已完结]如何从理论化学来分析分子的稳定性    ( 1 2 ) (12/3184) jjajxah 2012-04-29 2012-04-30 19:07:17 by jjajxah
[MS] [已完结]【求助】ms模拟纳米级Al2O3(1-20nm)的热力学性质 (3/974) fcg200808 2012-04-21 2012-04-30 13:58:35 by 模拟分子
[其他] [已完结]Music软件做MD时的初始结构文件如何获得 (1/516) sdwfhtzyh 2012-04-22 2012-04-30 13:07:43 by zyj8119
[其他] [已完结]请问什么软件可以模拟出电子云密度等,最好还能告知教程在何处    ( 1 2 ) (11/4136) 残暴的肉球 2012-04-29 2012-04-30 09:04:39 by lishijunzong
[其他] 一天一报价 (2/530) yuguangyun 2012-04-28 2012-04-30 08:46:08 by yuguangyun
[MS] [已完结][关贴]Morphology 模块使用求助 (0/654) caijj09 2012-04-29 2012-04-29 22:12:50 by caijj09
[Monte C ] [已完结]Mento Carlo编程时,怎么给分子分配坐标。。。。 (0/635) xinji 2012-04-29 2012-04-29 18:03:39 by xinji
[其他] [已完结]Gaussian模拟 (0/781) kltshui 2012-04-29 2012-04-29 16:35:46 by kltshui
[MS] [已完结]求助 (2/339) hjfdgg 2012-04-24 2012-04-29 14:40:44 by caijj09
[MS] [已完结]建立氯化钾离子化合物 (1/967) hjfdgg 2012-04-27 2012-04-29 14:24:30 by caijj09
[专家会诊] 要做好药物分子设计需要掌握哪些知识 (4/1256) ylp 2012-04-27 2012-04-28 23:19:34 by sfwere
[DS/Syby ] [已完结]ds在libdock时出错怎么办 (6/1226) 鸡腿套餐 2012-04-23 2012-04-28 20:59:01 by yuguangyun
[Gromacs ] [已完结]如何分析溶质在溶液中的构型分布情况    ( 1 2 ) (13/2867) liudiwen 2012-04-18 2012-04-28 17:20:25 by q1036210267
[DS/Syby ] [已完结]如何提高null cost值 (0/298) sfw007 2012-04-28 2012-04-28 13:14:29 by sfw007
[MS] [已完结]请问MS可以计算水溶液中的晶面能吗? (3/1206) lycoco 2012-04-27 2012-04-28 12:44:05 by huixia_03
[DS/Syby ] [已完结]Sybyl中Dynamic模块如何使用?与其它动力学软件有什么区别? (0/313) win雨 2012-04-28 2012-04-28 10:36:09 by win雨
[MS] [已完结]MS建α-Al2O3模型 (1/636) fcg200808 2012-04-27 2012-04-27 19:49:46 by chaizhm
[专家会诊] [已完结]结构优化时晶胞参数设置? (1/968) jianying8996 2012-04-20 2012-04-27 19:10:46 by jianying8996
[专家会诊] [已完结]如何得到有机化合物分子的体积参数?(PSA,MSA,SASA) (2/2414) 愿得一人心 2012-04-11 2012-04-27 18:50:53 by 愿得一人心
[Gromacs ] [关贴]amber怎么建立一个乙醇溶剂盒子? (1/865) 903566945 2012-04-27 2012-04-27 17:30:19 by liangliang88
[LAMMPS/ ] 【讨论】npt压力控制问题    ( 1 2 ) (评阅+1) (10/5452) zqlee 2010-12-21 2012-04-27 17:26:06 by 老虎大王
[其他] [已完结]新手求助:用高斯03/09能否计算logP? (0/505) xiuhui 2012-04-27 2012-04-27 16:22:59 by xiuhui
[Gromacs ] [已完结][关贴]AMBER小分子生成出错 (1/460) 903566945 2012-04-25 2012-04-27 16:20:42 by ferlich
[LAMMPS/ ] [已完结][关贴]关于用Lammps模拟Cu熔点的例子问题 (7/5711) dd5818 2012-03-08 2012-04-27 16:03:44 by abinitio
[Gromacs ] [已完结]怎么确定体系的衰减时间 (2/473) zhongyunxia 2012-04-27 2012-04-27 15:48:51 by zhongyunxia
[其他] [已完结]溶剂挥发自组装模拟软件 (5/1669) 林樘林 2012-04-13 2012-04-27 15:06:15 by 安德
[专家会诊] [已完结]求问各位大侠,模拟计算能否算出有机溶液中多硫离子的紫外和红外吸收光谱? (5/1302) xiaobo1255 2012-04-18 2012-04-27 15:06:05 by janet466158
[LAMMPS/ ] [已完结]lammps下rdf计算问题 (1/1927) jomo0511 2012-04-27 2012-04-27 14:28:27 by sdzjc1988
[MS] [已完结]哪位大侠帮我计算一下这个分子的尺寸 (1/693) 飘伶人 2012-04-27 2012-04-27 12:34:06 by caijj09
[MS] [已完结]二氧化硅吸水模型的建立 (2/1032) hjfdgg 2012-04-25 2012-04-27 11:02:49 by 北木
[MS] [已完结]下载了一份PDB文件,用什么软件打开?    ( 1 2 ) (12/3957) mumun 2012-04-18 2012-04-27 10:48:38 by 北木
[MS] 输入分子三维wy信息,用什么软件生成分子三维结构图 (3/1117) mfkscpy 2012-04-26 2012-04-27 10:12:45 by q1036210267
[Gromacs ] [已完结][关贴]溶剂盒子 (0/280) liudiwen 2012-04-27 2012-04-27 09:06:27 by liudiwen
[LAMMPS/ ] [已完结]求给一个windows下的VMD安装包? (2/3116) sy11052 2012-04-26 2012-04-27 08:23:35 by jiaoyixiong
[DS/Syby ] 关于DS中的Cdocker (9/1968) wxwsunny87 2011-11-24 2012-04-27 06:29:36 by wwb168
[专家会诊] [已完结][关贴]请问得了痒疹怎样治疗才能有效?求名医解答! (0/319) weiyongkai 2012-04-26 2012-04-26 23:59:43 by weiyongkai
[Gromacs ] [已完结][关贴]Gromacs水中的溶菌酶npt平衡出错 (3/2433) 604758762 2012-04-26 2012-04-26 21:11:19 by andylau286
[DS/Syby ] [已完结]在windows下如何将.mol2格式的分子导入database数据库中 (8/3426) shouling 2012-03-05 2012-04-26 17:19:26 by d_for
[DS/Syby ] [已完结]怎样准备配体和受体啊? (1/957) kyleye 2012-04-26 2012-04-26 16:48:10 by zh1987hs
[DS/Syby ] [已完结]DS中如何分子叠加 (1/888) kekexiliwolf 2012-04-26 2012-04-26 14:56:27 by blue_cat
[MS] [已完结]求助103错误。。。谢谢 (3/1080) 一起来化学 2012-04-21 2012-04-26 14:04:09 by 一起来化学
[DS/Syby ] [已完结]关于甲基喹啉酮乙酸类醛糖还原酶抑制的分子对接研究 (1/475) 373857802 2012-04-24 2012-04-26 11:06:31 by 373857802
[MS] [已完结]运行动力学模拟过程中H键势能一直为零? (6/1508) wangyiyongwz 2012-04-24 2012-04-26 10:07:48 by wangyiyongwz
[Gromacs ] [已完结]请大家看看我的磷脂膜初始结构,如何镜像一下? (2/751) sheva7love 2012-04-24 2012-04-26 09:13:05 by sheva7love
[MS] [已完结]TODOCK中torsion最大值常数怎么设置 (4/937) lid5251 2012-04-23 2012-04-25 19:41:09 by lid5251
[Monte C ] [已完结]想用蒙特卡洛模拟溶液结构 求各位大侠指点 (1/764) ssbug 2012-04-18 2012-04-25 18:58:02 by zhang_jaj
[LAMMPS/ ] 【求助】lammps如何测量模拟以后材料的晶格参数? (7/2375) bs340248 2010-05-24 2012-04-25 15:44:11 by rush7
[LAMMPS/ ] [已完结]没编译成功吗? (3/1046) stonezhoujun 2011-12-12 2012-04-25 15:43:13 by rush7
[其他] [已完结][关贴]安装CHARMM (0/392) liudiwen 2012-04-25 2012-04-25 11:17:41 by liudiwen
[DS/Syby ] [已完结]求Sybyl软件中的Muse软件,有这个软件的虫友帮下忙啊!! (2/955) jinjingnan 2012-03-21 2012-04-25 09:20:29 by aqiao
[LAMMPS/ ] [已完结]石墨烯拉伸力学性质模拟 (1/948) wuzhihua1988 2012-04-22 2012-04-25 08:43:42 by yuanxm
[MS] [已完结]怎样对周期边界下的水溶液进行隐藏处理! (4/902) wangyiyongwz 2012-04-23 2012-04-24 21:05:58 by 安德
[Gromacs ] GROMACS 中如何输入输出的chain , segname , 等信息? (0/353) jiaoyixiong 2012-04-24 2012-04-24 20:55:24 by jiaoyixiong
[MS] [已完结]小弟初用ms5.5,哪位大哥叫我下怎么用它建模, (1/378) yyxhfw 2012-04-24 2012-04-24 19:03:18 by caijj09
[MS] [已完结]求助··· (3/463) sqbin0615 2012-04-14 2012-04-24 17:22:07 by sikasun
[Gromacs ] [已完结]求Amber实现靶向分子动力学的教程 (2/1162) yanggy169 2012-04-24 2012-04-24 11:11:44 by 377563313
[DS/Syby ] [已完结]关于甲基喹啉酮乙酸类醛糖还原酶抑制的分子对接研究 (5/1422) 373857802 2012-04-08 2012-04-24 10:29:11 by 373857802
[MS] [已完结]forcite模块中的opotimize cell 选项问题? (5/1845) xiuhui 2012-04-22 2012-04-24 09:23:47 by xiuhui
[ME/Gulp] [已完结]ME建立晶体模型问题 (2/538) xiaowawa2222 2012-04-23 2012-04-24 09:14:52 by xiaowawa2222
[ME/Gulp] 【求助】求助ME的建模问题 (评阅+1) (4/998) malei123 2010-12-08 2012-04-24 06:23:52 by xiaowawa2222
[MS] [已完结]如何知道分子链的尺寸 (5/1240) nisternooy 2012-03-30 2012-04-23 21:14:45 by caijj09
[LAMMPS/ ] [已完结]这种边界条件应该怎么设置 (0/1103) 南风小斯 2012-04-23 2012-04-23 20:33:36 by 南风小斯
[Gromacs ] [关贴]AMBER生成输入文件的问题? (0/419) 903566945 2012-04-23 2012-04-23 19:06:34 by 903566945
[其他] [关贴]【求助】求教DPD高手怎样用amorphous cell计算Flory huggins参数 (8/3525) judy1931 2011-03-25 2012-04-23 18:58:24 by 水月笼沙
[专家会诊] [已完结][关贴]有关forcite模块中analysis中的几个问题,希望高手出手相救 (4/916) 青菜001 2012-04-20 2012-04-23 17:36:12 by 青菜001
[专家会诊] [已完结]GuassVIEW 如何看二面角 (0/596) ak47b52mp5 2012-04-23 2012-04-23 16:47:52 by ak47b52mp5
[MS] [已完结]MS 吸附能的计算 (3/2955) xiuhui 2012-04-21 2012-04-23 16:41:56 by caijj09
[专家会诊] [已完结][关贴]Lubaehevsky Stillinger algorithm(LS算法) (0/443) lyw867 2012-04-23 2012-04-23 15:54:06 by lyw867
[DS/Syby ] [已完结]AutoDock对接结果中具体结合部位相互作用如何分析 (2/3025) 可米kemi 2012-04-23 2012-04-23 14:58:10 by zh1987hs
[MS] [已完结]非晶合金的模拟 (0/371) 1026580419 2012-04-23 2012-04-23 11:32:07 by 1026580419
[其他] [已完结]布朗动力学模拟中的时间步长如何选择? (2/627) lpc_zard 2012-04-16 2012-04-23 11:24:36 by chaizhm
[MS] [已完结]MS 动力学 :冻结问题 (4/910) xiuhui 2012-04-21 2012-04-23 10:51:04 by caijj09
[DS/Syby ] [已完结][关贴]关于GOLD和autodock的打分函数和自由能计算 (0/1898) cfmzxf84 2012-04-23 2012-04-23 10:33:16 by cfmzxf84
[DS/Syby ] 精华I:  【原创】convert0.2 批量转化分子格式的小程序-updating 2010-05-28 (11/5144) javacfish 2009-12-17 2012-04-23 07:46:21 by liuwei4410
[MS] MS的传承--雁过留声 (评阅+5) (2/664) 王小一 2012-02-26 2012-04-22 22:23:11 by wgk1207
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