24小时热门版块排行榜    

北京石油化工学院2026年研究生招生接收调剂公告

管理团队 (金币库 69402 充值 )

主管区长:
月只蓝小红豆
主管版主:
abinitio沙漠猎人

杰出贡献者

回帖排序 发表排序 刷新页面  |  交流  |  求助  |  资源精华区 作者 最后发表
[热点] 调剂 好好读书。 2026-04-06 刚刚
[Gromacs ] [已完结]amber 动力学 Na+ 坐标出错 (0/243) lanlanok 2012-03-20 2012-03-20 16:45:20 by lanlanok
[MS] [已完结]请教一个MS中Polymorph模块的相关问题 (0/400) swollow321 2012-03-20 2012-03-20 15:15:38 by swollow321
[Gromacs ] [已完结]本科新手,NAMD 做分子模拟,学习受阻,求教~~ (3/1288) 947468266 2012-01-25 2012-03-20 14:47:30 by linlin9
[Gromacs ] [已完结]借助tcl脚本,VMD可以分析一些特别的分布函数么? (1/725) 小白如水 2012-03-20 2012-03-20 12:48:02 by 小白如水
[DS/Syby ] 【分享】非常好的 Autodock/Vina plugin for PyMOL (8/2660) sign 2010-04-23 2012-03-20 07:45:04 by lylyly2006
[DS/Syby ] DS 2.5 没有 creat 3d-qsar的模块 (1/309) sunmuer 2011-12-27 2012-03-20 06:51:08 by aqiao
[Monte C ] 【资源】一个关于Monte Carlo method 的小程序+化学 (评阅+5) (5/1400) kafka0 2011-02-06 2012-03-20 03:12:58 by lanshuiquan
[MS] [已完结]30金币求linux 下的MS4.4 (0/151) yiyayi 2012-03-19 2012-03-19 17:58:46 by yiyayi
[DS/Syby ] [已完结]DS新手做MD求请教 (0/226) 措诺有嘉 2012-03-19 2012-03-19 16:29:26 by 措诺有嘉
[MS] [已完结]求助啊! Equilibrium Morphology的使用要求是什么 对晶体模型有什么要求 (0/330) vivi_131499 2012-03-19 2012-03-19 16:10:59 by vivi_131499
[LAMMPS/ ] [已完结]关于Potentials of gas 的问题 (0/288) mengwuyu 2012-03-19 2012-03-19 15:32:45 by mengwuyu
[MS] [已完结]优化结构出错,没提示在哪错的,求助! (6/1866) shangxh 2011-11-04 2012-03-19 13:53:25 by frank797
[MS] [已完结]用dmol模块做有机物分子结构模拟参数设置问题 (6/1024) eden 2012-03-08 2012-03-19 12:03:21 by vv_tian78
[其他] [已完结]哪位大侠知道二硫化钨中W和S的结合键能 (0/411) dkw06030141 2012-03-18 2012-03-18 12:59:18 by dkw06030141
[其他] [已完结]怎么用Abbott公式计算第二维里系数? (0/768) xinji 2012-03-18 2012-03-18 00:53:20 by xinji
[Gromacs ] 【求助】向bay__gulf求助!!    ( 1 2 ) (15/2074) jianchaoyv 2010-06-22 2012-03-17 13:35:49 by 雪扬0613
[MS] [已完结]MS 用CASTEP计算失败,gateway的问题 (5/2191) coyboy1 2012-02-05 2012-03-17 11:55:39 by hwceng0816
[LAMMPS/ ] [已完结]请教高手: LJ势中的指数只能是6-12吗? (4/1330) amannnn 2012-03-16 2012-03-17 06:58:29 by wl1777
[DS/Syby ] [已完结]找discovery studio 方面的书籍 (2/783) gwh775 2012-02-25 2012-03-16 15:18:09 by 梦缘梦缘
[MS] [已完结]跪求 (0/147) S100161711 2012-03-16 2012-03-16 09:54:13 by S100161711
[Gromacs ] [已完结]VMD分析残基RMSD (0/2354) 蓝紫色玻璃心 2012-03-16 2012-03-16 09:46:38 by 蓝紫色玻璃心
[Gromacs ] [已完结]gromacs tabulated 报错 (0/558) ruthxu 2012-03-15 2012-03-15 23:28:07 by ruthxu
[Gromacs ] [已完结]求助如何生成有机物Amber的输入文件,无PDB文件。 (4/1337) 903566945 2012-02-21 2012-03-15 16:26:04 by jianying8996
[MS] 如何采用material studio计算均方回转半径 (0/3162) kingswordscu 2012-03-15 2012-03-15 16:08:10 by kingswordscu
[专家会诊] [已完结]分子动力学模拟non-bond参数选择问题 (0/586) smx07131301 2012-03-15 2012-03-15 16:05:31 by smx07131301
[DS/Syby ] 【求助】用DS2.5来做基于受体的药效团设计,有问题请求帮助解答! (3/780) leirongjian 2011-03-23 2012-03-15 12:10:32 by xuzhj01
[LAMMPS/ ] [已完结]NEMD模拟中,MP型粒子交换,角动量不守恒的问题 (1/539) lbh_xt 2012-02-23 2012-03-15 11:37:20 by donghai
[LAMMPS/ ] [已完结]NEMD方法的MP模型问题 (1/323) lbh_xt 2012-02-21 2012-03-15 11:32:16 by donghai
[MS] 如何实用Equilibrium Morphology计算 (1/497) vivi_131499 2012-03-14 2012-03-15 11:13:54 by vivi_131499
[DS/Syby ] [已完结]药效团,COMFA (5/1845) win雨 2012-03-12 2012-03-15 10:20:27 by xuzhj01
[Gromacs ] 【求助】怎么形成碳纳米管 (9/2069) xiaoyingw 2010-12-02 2012-03-15 07:18:01 by wshzxcc
[Gromacs ] 蛋白质pk值的计算 (0/1012) candery 2012-03-14 2012-03-14 20:13:12 by candery
[MS] [已完结]discover 模拟密度问题 (0/240) 973489386 2012-03-14 2012-03-14 19:25:23 by 973489386
[ME/Gulp] Gulp 怎么拟合声子谱? (1/594) w76990480 2011-08-17 2012-03-14 16:44:46 by oxox6085
[Monte C ] [已完结]Monte Carlo 简单编程交流 (0/434) gordon2008 2012-03-14 2012-03-14 13:04:29 by gordon2008
[MS] [已完结]对称分子的模拟建立 (4/914) jixiao0526 2012-03-04 2012-03-14 11:59:41 by o58285880
[MS] [已完结]MS rutileTiO2(110)表面建模 (2/1210) 573846297 2012-03-13 2012-03-14 08:51:58 by chaizhm
[Gromacs ] [已完结][关贴]分子对接后小分子配体利用AntechAmber构建力场的问题 (1/1408) wangyan10 2012-03-13 2012-03-14 04:02:52 by fantastic
[Monte C ] [已完结]蒙特卡洛 重要取样法 原理问题 跪求 (3/812) lyw867 2012-02-23 2012-03-13 23:29:05 by lsj-ciac
[MS] [已完结]帮忙画一个高氯酸铵分子的xsd文件,优化好,用来计算的,急用,谢谢! (1/216) 09cj513 2012-03-13 2012-03-13 20:24:08 by 09cj513
[其他] [已完结]请教有没有什么软件可以计算分析或离子的大小??谢谢! (2/221) lxmashj 2012-03-11 2012-03-13 18:25:19 by lxmashj
[MS] [已完结]周期性边界条件相关问题 (6/3503) smx07131301 2012-03-12 2012-03-13 17:09:02 by 诗意栖居
[MS] [已完结]老板刚让用MS做卟啉的分子模拟,请问大家配备太性能优越的笔记本可否够用? (9/1955) 六世之爱 2012-03-03 2012-03-13 12:11:25 by o58285880
[其他] [已完结]求 苝二酰亚胺 结构文件!!!!! (1/573) 黑狼鸟 2012-03-13 2012-03-13 10:25:19 by 黑狼鸟
[其他] [已完结]求助一个小分子长度:戊二醛 (1/221) ldpirlo 2012-03-12 2012-03-13 10:25:14 by ldpirlo
[MS] [已完结]dmol3吸附优化不收敛 (3/1639) 落雨辰砂 2012-03-11 2012-03-13 09:34:39 by 落雨辰砂
[LAMMPS/ ] [已完结]请问分子动力学可以求解材料的导电率么? (3/1341) wang06x 2012-03-07 2012-03-13 08:58:52 by wang06x
[Gromacs ] [已完结]关于GMX中带基底以及溶剂转换问题 (2/355) 草莓米粑 2012-03-10 2012-03-13 08:47:08 by 草莓米粑
[Gromacs ] [已完结]如何做动力学模拟pdb文件 (4/1534) 志在必得 2012-03-09 2012-03-13 08:26:42 by 郝明
[ME/Gulp] [已完结]扩散结果分析 (2/779) txf10 2012-02-17 2012-03-12 23:15:33 by w76990480
[MS] [已完结]MS (1/332) zhengwwdw 2012-03-12 2012-03-12 23:04:27 by w76990480
[其他] 【求助】SVM做回归 (1/543) zml2009 2011-02-18 2012-03-12 17:42:31 by congyong
[其他] [已完结]如何得到分子参数 (2/272) xylecust 2012-03-08 2012-03-12 10:36:36 by xylecust
[Gromacs ] [已完结]那位给画个N-H和C=C的分子能级图啊 (3/1290) lnikuaix 2012-03-10 2012-03-11 10:43:39 by awmc2008
[MS] [已完结]菜鸟求助大虾 (0/165) sqbin0615 2012-03-11 2012-03-11 09:15:01 by sqbin0615
[LAMMPS/ ] [已完结]DL_POLY关于ryck二面角势能的输入 (3/554) neweroica 2012-03-07 2012-03-11 08:54:31 by neweroica
[Gromacs ] [已完结]ATP分子力场参数怎么做 (4/2289) 超人与小木虫 2012-03-09 2012-03-10 19:57:43 by 超人与小木虫
[其他] [已完结]做离子液体的分子模拟,用哪个分子模拟的软件好呢? (3/1794) alang3620 2012-03-08 2012-03-10 18:28:46 by yalefield
[Gromacs ] [已完结]AMBER算cross-correlation analysis脚本 (1/625) lsylsylsy 2011-12-07 2012-03-10 11:52:16 by ning0615
[MS] [已完结][关贴]CASTEP模拟声子谱,如何设置温度啊 (1/872) longwei1221 2011-11-17 2012-03-10 10:01:31 by niuxihao
[MS] [已完结]请教一个MS预测晶体构型的问题 (0/428) swollow321 2012-03-10 2012-03-10 09:29:50 by swollow321
[DS/Syby ] [已完结]DS帮助文件无法打开 (1/300) zzy19860123 2012-03-04 2012-03-09 20:29:25 by wangyan10
[Gromacs ] [已完结]如何建立非水溶剂盒子 (0/824) 志在必得 2012-03-09 2012-03-09 11:39:34 by 志在必得
[LAMMPS/ ] [已完结]在Lammps中安装xmovie工具时,Makefile文件怎么修改X库路径 (3/1678) xjw040 2012-03-05 2012-03-09 03:00:23 by chaonie
[专家会诊] [已完结][关贴]有无可分析鉴定两个分子可否结合或互作的软件? (0/412) xtsheep 2012-03-08 2012-03-08 18:17:41 by xtsheep
[MS] [已完结]新手遇到问题,求赐教 (3/816) lrccc16 2012-03-05 2012-03-08 17:10:00 by 水晶蚂蚁
[专家会诊] [已完结]应该选用什么软件啊 (5/1306) bsdanger 2012-03-03 2012-03-08 08:18:09 by jiaoyixiong
[LAMMPS/ ] [已完结]Bad Fene bond (2/2128) chaonie 2012-03-07 2012-03-08 07:19:07 by chaonie
[MS] [已完结]ms画图碳原子间键的连接? (9/2953) jianying8996 2012-03-05 2012-03-07 21:29:00 by 350735697
[DS/Syby ] 关于酶蛋白模型的rmsd问题 (1/576) 870609 2012-03-06 2012-03-07 20:35:38 by jbolid
[Gromacs ] [已完结]两个盒子叠加问题 (2/1139) zhongyunxia 2012-03-07 2012-03-07 19:49:19 by zhongyunxia
[ME/Gulp] [专家] [已完结]求助啊!!L-J势能如何设置?老是算不对! (1/1861) oxox6085 2012-02-28 2012-03-07 18:27:54 by oxox6085
[MS] [已完结]如何模拟碳纳米管在水中超声分散 (0/443) bsdanger 2012-03-07 2012-03-07 00:46:25 by bsdanger
[ME/Gulp] 【求助】在GULP里面如何固定原子位置? (2/890) oytxtu 2010-12-15 2012-03-06 23:37:53 by qiaqiafeng
[MS] [已完结]MS建盒子跑动力学具体操作 (0/292) xinye99 2012-03-06 2012-03-06 21:42:04 by xinye99
[MS] [已完结]请问天津大学有分子动力学模拟网络教育没? (0/302) 萱月琪琪 2012-03-06 2012-03-06 18:27:49 by 萱月琪琪
[ME/Gulp] [已完结]求助GULP中如何设置lennard_jones势函数 (1/965) oytxtu 2012-02-07 2012-03-06 17:48:15 by oxox6085
[MS] [已完结][关贴]用MS建的模型出现的问题 (0/246) 北木 2012-03-06 2012-03-06 16:08:52 by 北木
[Gromacs ] [已完结]郎之万动力学出错 (2/1222) 莱维 2012-02-28 2012-03-06 14:14:25 by 莱维
[DS/Syby ] 分子对接及打分函数    ( 1 2 ) (12/8777) candery 2012-02-06 2012-03-06 09:20:12 by tinasheen
[MS] [已完结]谁能提供创腾科技 代亚东博士 的联系方式? (4/1274) sunyulong 2012-03-03 2012-03-05 22:00:02 by sunyulong
[MS] [已完结][关贴]求助 (0/169) zxl523 2012-03-05 2012-03-05 15:24:05 by zxl523
[MS] [关贴]在Materials-studio 4.4建模遇到问题 (0/358) zxl523 2012-03-05 2012-03-05 13:30:32 by zxl523
[其他] 【求助】求能够在WIN7下正常安装使用的material studio 软件。 (6/2196) chenmingfeng 2011-03-24 2012-03-05 13:27:47 by yingwu528
[资源] MATERIALS MODELING.pdf (5/790) ohnesie 2012-03-03 2012-03-05 12:46:24 by wmnick
[Gromacs ] [已完结]分window的smd模拟研究探讨 (0/467) dreamtiger 2012-03-05 2012-03-05 11:31:16 by dreamtiger
[DS/Syby ] 酶蛋白同源建模后模型自带配体,是否还需要做对接??? (1/560) 870609 2012-03-05 2012-03-05 11:30:16 by houxuben
[Gromacs ] [已完结]Amber中残基的限制 (0/822) 200618530201 2012-03-05 2012-03-05 11:01:28 by 200618530201
[MS] [已完结]求人做一个小分子与蛋白质分子对接 (0/566) muxu007 2012-03-05 2012-03-05 10:58:41 by muxu007
[Gromacs ] [已完结]amber 9蛋白质的准备工作 (0/242) sunmuer 2012-03-05 2012-03-05 10:31:01 by sunmuer
[Gromacs ] [已完结]虫友帮忙:知道怎么用gromacs算焓变吗? (1/673) zhongyunxia 2012-03-02 2012-03-05 08:26:38 by zhongyunxia
[DS/Syby ] [已完结]COMFA,如何显示除了R1,R2以外的母环 (2/347) sunmuer 2012-03-01 2012-03-05 07:33:11 by sunmuer
[MS] [已完结][关贴]discover跑NVT失败,大家看看是什么问题 (2/357) premonkey 2012-02-29 2012-03-04 17:07:08 by 973489386
[MS] [已完结]纳米碳管和药物相互作用 (0/187) phbgp 2012-03-04 2012-03-04 15:11:47 by phbgp
[MS] [已完结]求助:谁能帮我用MS建个高分子晶体模型啊? (2/351) 903566945 2012-03-02 2012-03-04 12:10:14 by 903566945
[DS/Syby ] [已完结]modeller multiple templates求助    ( 1 2 ) (11/1576) nufang19a 2012-02-28 2012-03-04 10:41:42 by nufang19a
[MS] [已完结]模拟硫酸钙结晶以后,计算得到的水的扩散系数为零是怎么回事? (2/373) 阳光8619 2012-03-02 2012-03-03 18:54:19 by 阳光8619
[MS] [已完结]溶剂效应 (2/398) ecustcl 2011-07-04 2012-03-03 18:07:01 by ecustcl
[Gromacs ] [已完结][关贴]请教关于模拟退火的问题 (0/1224) budgerigar 2012-03-03 2012-03-03 16:36:24 by budgerigar
[LAMMPS/ ] 【讨论】dlpoly能量不收敛 (3/1236) yy10841010 2010-04-25 2012-03-03 15:52:49 by ohnesie
相关版块跳转
查看