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[热点] 售一区SCI文章T0P,我:8O.551.O54,科目全,可十急 1uaZt2kAZj2S 2026-11-01 刚刚
[MS] [已完结]求助:MS里sorption版块密度-孔径分布曲线图如何做?是否直接有?我用的是MS 7.0 (2/2172) Quasidomo 2015-06-28 2015-07-07 15:57:00 by pigrass
[Monte C ] [已完结][关贴]请教sorption(MS)问题,请大神帮助 (6/3960) sunny11223 2015-06-15 2015-07-07 15:40:57 by sunny11223
[MS] [已完结]实现模拟同时使用电脑处理文档、上网 (0/313) chenmoysj 2015-07-07 2015-07-07 14:44:59 by chenmoysj
[其他] [已完结]code Music GCMC中怎么确定算的是等温吸附性还是载荷? (0/461) 李路lulu 2015-07-07 2015-07-07 09:14:12 by 李路lulu
[其他] [已完结]双条链的同源模建 (0/450) 893932098 2015-07-06 2015-07-06 19:21:20 by 893932098
[LAMMPS/ ] [已完结]linux下多个输入文件的计算任务如何提交? (0/481) wd12309812 2015-07-06 2015-07-06 17:08:15 by wd12309812
[专家会诊] [已完结]不同的酶与一种配体的对接属于什么范畴? (1/564) 螺旋藻 2015-07-03 2015-07-06 10:22:50 by pymol
[MS] [已完结]溶解度参数 (评阅+1) (4/2359) zhliang555 2015-07-01 2015-07-06 09:55:59 by wendifu
[MS] [已完结]求MS关于金团簇建模的相关文献 (评阅+1) (8/994) 小杜叠罗 2015-07-01 2015-07-06 08:24:47 by dota_sao
[MS] [已完结]白云母castep优化失败问题 (2/748) 点点滴滴2 2011-12-01 2015-07-06 07:27:46 by zlywzjm
[Gromacs ] [已完结]求助dcd 的SDF如何做?以及图中的SDF所用软件 (评阅+6) (5/1278) 兰S水晶 2014-02-20 2015-07-06 06:04:33 by jianchuanliu
[Monte C ] [已完结]GEMC模拟轻烃物系的气液相平衡,NPT系综,MOVE和Cut-off值如何选择? (4/1251) 红精灵 2012-12-22 2015-07-05 13:26:06 by lalong8400
[DS/Syby ] [已完结]哪位朋友有SYBYL-X 教学视频 源资科技官网的视频在线看不了 (3/1270) majunjie3612 2014-12-04 2015-07-04 17:36:00 by xufund
[MS] [已完结]MS分子模拟和VASP计算分子吸附在催化剂模型的吸附能 (评阅+1) (2/4467) showtime0703 2014-07-27 2015-07-04 17:32:24 by zh11111
[LAMMPS/ ] [已完结]纳米团簇-NVT系统    ( 1 2 ) (10/2691) lchunmei001 2013-05-16 2015-07-04 17:19:57 by feifeikeke
[Monte C ] [已完结]MUSIC求助哇。。。新手求教。。 (评阅+2) (8/1550) ganggang2007 2014-02-19 2015-07-04 12:43:25 by sunny11223
[MS] [已完结]Forcite算分子动力学,所有的原子都没有电荷 (0/985) czj1019 2015-07-04 2015-07-04 00:03:34 by czj1019
[MS] [已完结]求助 (1/321) hjfdgg 2012-09-28 2015-07-03 21:12:32 by Sophiezx45
[Gromacs ] [已完结]有关离子液体的力场参数问题 (1/1111) maijunlin 2015-06-17 2015-07-03 15:24:27 by franksha
[LAMMPS/ ] [已完结]用lammps模拟位移加载时的弛豫时间问题 (0/1106) SA14005 2015-07-03 2015-07-03 13:26:03 by SA14005
[MS] [已完结]二十烯有机分子模型构建 (评阅+1) (1/532) 小小女巫 2015-05-14 2015-07-03 10:14:11 by bank0
[MS] [已完结]能否通过 NAMD,VMD,Gaussian 09获得离子液体的Density,RDF,SDF (评阅+1) (4/1017) kingwellnj 2015-06-17 2015-07-03 08:27:36 by kingwellnj
[专家会诊] [已完结][关贴]请问在做FeS2和Fe2O3时,如何计算 (1/837) 矿物学博士 2015-07-01 2015-07-02 17:29:00 by 矿物学博士
[其他] [已完结]namd/vmd使用求助 (评阅+1) (5/2003) mchyhxmyzn 2015-04-07 2015-07-02 07:49:41 by 915384165
[Gromacs ] [已完结]分析二面角分布 (dihedral angle distribution) (评阅+1) (4/2687) gn02530640 2015-04-22 2015-07-02 07:40:02 by 915384165
[专家会诊] [已完结][关贴]如何计算标况下圆管中气体分子与圆管壁的碰撞频率? (0/651) 锂电说_Alan 2015-07-01 2015-07-01 21:21:56 by 夕阳侠客
[MS] [已完结]solvation properties是什么意思? (0/979) zhliang555 2015-07-01 2015-07-01 16:16:14 by zhliang555
[MS] [已完结][关贴]请问在做FeS2和Fe2O3时,求助 (0/1389) 矿物学博士 2015-07-01 2015-07-01 09:41:45 by 矿物学博士
[Gromacs ] [已完结]用namd软件做SMD时出错,该如何解决! (4/1204) lpz610 2012-10-06 2015-07-01 06:54:03 by 素君~~~
[DS/Syby ] [已完结]sybyl 分子对接 怎么根据与原配体比较 来判断sdf文件中哪个化合物对接的较好 (0/932) happychen621 2015-06-30 2015-06-30 21:50:21 by happychen621
[DS/Syby ] [已完结]想做分子对接,有关配体能量最小化的问题。请前辈指点,谢谢! (评阅+1) (5/2990) 螺旋藻 2015-04-11 2015-06-30 18:37:06 by xx7353
[专家会诊] [已完结]关于origin作图问题 (1/789) xiaochabei0 2015-06-30 2015-06-30 16:57:25 by 月只蓝
[LAMMPS/ ] [已完结]为何我的计算卡在setting up run ,不动了? (0/1000) weiyidan 2015-06-30 2015-06-30 14:24:56 by weiyidan
[LAMMPS/ ] [已完结]石墨烯的热导率计算结果,热导率突增 (0/1047) Yolanda_syy 2015-06-30 2015-06-30 09:55:53 by Yolanda_syy
[LAMMPS/ ] [已完结]Lammps rotate 求助 (评阅+1) (4/1769) atfqf 2015-01-02 2015-06-29 18:15:23 by gzf1991929
[MS] [已完结][关贴]算吉布斯自由能 (0/1475) 898766282 2015-06-29 2015-06-29 17:53:43 by 898766282
[其他] [已完结][关贴]code-MUSIC错误: atom name does not exist in atoms structure: C (0/423) 李路lulu 2015-06-29 2015-06-29 11:34:53 by 李路lulu
[MS] [已完结]请问多组分气体分子扩散怎么计算呢? (0/1146) 锂电说_Alan 2015-06-27 2015-06-27 10:53:11 by 夕阳侠客
[MS] [已完结]求一篇有emimtf2n跑动力学做.key文件所需力场参数的文献,拜托拜托 (0/278) 岳丽丽75 2015-06-26 2015-06-26 09:04:21 by 岳丽丽75
[Gromacs ] [已完结]gromacs中,一个小分子然后加水是如何操作的? (评阅+1) (5/1637) lingogo 2015-05-03 2015-06-26 03:41:06 by 沐风雨林
[Gromacs ] [已完结]gromacs分析命令 (评阅+1) (1/938) Aimee6002 2015-05-13 2015-06-25 23:18:35 by angjzy
[Gromacs ] [已完结]请教VMD周期性显示问题 (1/3808) jolly1987 2015-06-23 2015-06-25 23:05:04 by angjzy
[DS/Syby ] [已完结][关贴]软件DS 查看对接结果出的问题 (3/1269) 小馨月 2015-05-12 2015-06-25 18:51:10 by 小馨月
[MS] [已完结]求助 (评阅+1) (3/679) zhuss0821 2015-06-18 2015-06-25 16:51:27 by 月只蓝
[MS] [已完结]The trajectory is marked as invalid. (5/5646) 愤怒的姿态 2012-11-06 2015-06-25 11:47:49 by catherine56
[其他] [已完结]dftb+中 Nose-Hoover调温方法中各参数的意义 (4/1390) WDD880227 2012-11-12 2015-06-25 06:50:20 by 梦梦我之嫁
[MS] [已完结]求解该蛋白质结构的2D图是怎么画的? (0/1155) 397608492 2015-06-24 2015-06-24 16:33:04 by 397608492
[其他] [已完结][关贴]怎么生成mtz文件 (0/1126) 331268942 2015-06-24 2015-06-24 16:19:54 by 331268942
[其他] [已完结]用pymol软件怎样将α溶血素蛋白孔的横切图? (0/386) 专属天使@ 2015-06-24 2015-06-24 15:05:07 by 专属天使@
[MS] [已完结]可以用autodock将三个蛋白docking在一起么 (评阅+1) (5/1528) 桃花璎珞 2015-01-13 2015-06-24 14:55:27 by 白鸿明
[Gromacs ] [已完结]关于ABF PMF计算结果 (1/1587) shabeir 2011-09-16 2015-06-24 14:47:06 by 红颜不美
[LAMMPS/ ] [已完结]这个ABF计算结果要怎么看? (评阅+1) (1/1289) araqq 2014-07-04 2015-06-24 14:43:32 by 红颜不美
[LAMMPS/ ] [已完结][关贴]win7 64位下安装lammps ,MPI注册时显示Unable to run "mpiexec -register" (2/1836) china123wy 2015-06-21 2015-06-24 09:38:55 by china123wy
[DS/Syby ] [已完结]蛋白模拟 (0/997) zix1 2015-06-23 2015-06-23 21:43:51 by zix1
[LAMMPS/ ] [已完结]如何用lammps做单层石墨烯原子的弯曲 (0/802) Ergon 2015-06-23 2015-06-23 20:48:45 by Ergon
[MS] [已完结]DPD模块,怎样使meso结构变得finer,求大神指点!!! (0/606) oudegeshen 2015-06-23 2015-06-23 17:48:27 by oudegeshen
[MS] [已完结]materio studio知道了单晶结构怎样模拟其中的原子间的键能和其中的氢键键能 (评阅+1) (2/689) 心随意动 2015-06-20 2015-06-23 16:14:09 by 心随意动
[其他] [已完结]关于力场的编写 求擅长towhee的大神指导! (评阅+1) (2/970) 草田露 2015-06-22 2015-06-23 11:29:33 by 草田露
[MS] [已完结]dynamics 输出总能量怎么得到??? (0/277) Kiki.Hugh 2015-06-22 2015-06-22 19:57:39 by Kiki.Hugh
[MS] [已完结]【MS】计算聚合物与金属氧化物之间的结合能 (3/1348) 大米营养 2015-06-18 2015-06-19 18:18:47 by 大米营养
[MS] [已完结]关于forciet中的RDF的作图与分析 (0/823) JSL-chang 2015-06-19 2015-06-19 07:55:57 by JSL-chang
[MS] [已完结]我想使用ms建个模,类似于下图 (0/392) xxj9618 2015-06-18 2015-06-18 16:57:17 by xxj9618
[MS] [已完结]MS如何计算分子的热力学属性(以苯环为例) (0/1009) cmzjy123 2015-06-18 2015-06-18 14:39:33 by cmzjy123
[MS] [已完结]氢键问题 (评阅+1) (0/523) 毛雪彬 2015-06-18 2015-06-18 09:50:38 by 毛雪彬
[其他] [已完结]高斯软件模拟化合物二面角求助 (0/535) wong326 2015-06-17 2015-06-17 22:58:45 by wong326
[MS] [已完结]为何K值无法更改 (0/307) czj1019 2015-06-17 2015-06-17 22:05:45 by czj1019
[MS] [已完结]有人做高分子模拟的吗? (3/784) likun46 2015-06-11 2015-06-17 14:02:51 by likun46
[MS] [已完结]CASTEP 问题求助 (1/489) 石勤 2014-11-24 2015-06-17 12:59:20 by duanabing
[MS] [已完结]氢键能为什么是负值 (0/775) tangkangkang 2015-06-17 2015-06-17 11:01:29 by tangkangkang
[LAMMPS/ ] [已完结]lammps进行分子动力学模拟之前是不是一定要进行结构优化? (4/2773) xulisky 2015-06-15 2015-06-17 08:38:25 by abinitio
[MS] [已完结]ms的getway卸载之后重装的问题?? (0/476) peerlesszjh 2015-06-16 2015-06-16 17:49:19 by peerlesszjh
[专家会诊] [已完结]关于核酸和蛋白质对接的疑问 (0/1558) 五色茶 2015-06-16 2015-06-16 17:30:12 by 五色茶
[MS] [已完结]ms软件 AC模块儿问题? (0/848) peerlesszjh 2015-06-16 2015-06-16 16:39:22 by peerlesszjh
[MS] [已完结]如何补全蛋白质pdb结构中缺少的残基 (0/2906) lc5405 2015-06-16 2015-06-16 16:00:13 by lc5405
[MS] [已完结][关贴]模拟原子在晶体表面的连接过程 (0/333) ONGIONG 2015-06-16 2015-06-16 12:47:10 by lkd-syl
[LAMMPS/ ] [已完结]1--4 scale factors (0/392) 怜星追月 2015-06-15 2015-06-15 20:51:18 by 怜星追月
[MS] [已完结]求帮助 (2/484) 水影恋镜 2012-05-14 2015-06-15 12:22:19 by 萌萌的弱弱
[MS] [已完结]Amber 小分子参数 (1/2317) Shirley_Shui 2014-09-18 2015-06-14 11:58:56 by huangwendong
[LAMMPS/ ] [已完结]LAMMPS平衡法计算热导率出现了负值,怎么回事? (0/1065) mydnh52 2015-06-14 2015-06-14 09:21:28 by mydnh52
[其他] [已完结]NAMD中立方水体的生成 (评阅+1) (7/1454) lyjlyj6690 2015-05-08 2015-06-13 22:31:17 by 素君~~~
[MS] [已完结]Ms中加电场 (2/1443) 星-梦缘 2015-06-12 2015-06-13 09:31:47 by 星-梦缘
[MS] [已完结][关贴]Discover模块如何添加静电场 (1/539) xb490284223 2015-05-25 2015-06-12 21:57:02 by 176286641cc
[Monte C ] [已完结]atomeye  按原子类型显示 (0/829) zmus 2015-06-12 2015-06-12 20:44:58 by zmus
[MS] [已完结]MS-Sorption 模块模拟的FH势量子效应和μPT系综求助    ( 1 2 3 ) (21/2658) Voland 2013-09-04 2015-06-12 18:56:58 by sunny11223
[Monte C ] [已完结]Towhee overlap in initial configuration (1/452) hjy2940 2015-05-22 2015-06-12 17:31:33 by 992648352
[MS] [已完结]Si3N4的晶体结构cif求助 (0/2041) badercao 2015-06-12 2015-06-12 14:42:25 by badercao
[DS/Syby ] [已完结]sybyl软件下,两个同源小分子配体构象比较? (评阅+1) (2/728) 13581286695 2015-05-14 2015-06-12 10:10:52 by 爱吃粉丝的猫
[DS/Syby ] [已完结]COMFA的R平方,q平方说明了什么 (评阅+1) (1/1667) 256872 2015-05-27 2015-06-12 10:09:10 by 爱吃粉丝的猫
[专家会诊] [已完结]SYBYL-X刚性小分子对接 蛋白 (1/708) rock-willson 2015-06-01 2015-06-12 10:05:37 by 爱吃粉丝的猫
[DS/Syby ] [已完结]蛋白质相互作用 (评阅+1) (3/1813) 落木778 2015-05-22 2015-06-11 16:15:31 by wbingxin2012
[MS] [已完结]气体在石墨烯空隙中扩散动力学模拟报错、失败 (4/1108) 小虫_sang 2015-06-10 2015-06-11 15:15:42 by pigrass
[资源] [已完结]求中国天然产物数据库,急用,求大侠帮忙 (0/765) wbingxin2012 2015-06-11 2015-06-11 14:34:54 by wbingxin2012
[MS] [已完结]如何从下载的PDB文件中提取酶的活性中心 (6/3633) xctry 2012-02-25 2015-06-11 09:50:22 by charles08
[其他] [已完结][关贴]MUSIC 软件IRMOF1吸附CH4的例子 给的网址打不开,谁有下载好的? (评阅+1) (0/549) 李路lulu 2015-06-11 2015-06-11 09:31:41 by 李路lulu
[MS] [已完结]文献求助MS (0/309) nancy1707 2015-06-10 2015-06-10 23:07:11 by nancy1707
[Monte C ] [已完结]分子模拟 (1/685) kewenj_kwj 2015-06-04 2015-06-10 22:28:56 by 992648352
[Gromacs ] [已完结]请问有人知道该怎么分析一个球形胶束周围分子与胶束表面的角度关系? (0/473) 白玉浴血 2015-06-10 2015-06-10 20:46:32 by 白玉浴血
[DS/Syby ] [已完结]DS4.0 安装问题 (评阅+1) (4/1839) 萤火之光 2015-04-30 2015-06-10 16:08:04 by 萤火之光
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