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[热点] 售SCI文章,我:8O5.5.1.O.54,科目齐全,可+急 pwtWF7Qmx6Jw 2026-11-03 刚刚
[ME/Gulp] [已完结]求助GULP中如何设置lennard_jones势函数 (1/1053) 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 (0/293) 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 (2/1335) 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 ) (12/9358) 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? (4/1500) sunyulong 2012-03-03 2012-03-05 22:00:02 by sunyulong
[MS] [已完结][关贴]求助 (0/217) 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 (0/416) 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。 (6/2388) chenmingfeng 2011-03-24 2012-03-05 13:27:47 by yingwu528
[资源] MATERIALS MODELING.pdf (5/886) 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 (0/537) 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??? (1/631) 870609 2012-03-05 2012-03-05 11:30:16 by houxuben
[Gromacs ] [已完结]Amber中残基的限制 (0/864) 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 (0/617) 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 (0/289) 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? (1/769) 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 (2/447) 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 (2/457) 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 (0/233) 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? (2/442) 903566945 2012-03-02 2012-03-04 12:10:14 by 903566945
[DS/Syby ] [已完结]modeller multiple templates求助    ( 1 2 ) (11/1881) 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? (2/467) 阳光8619 2012-03-02 2012-03-03 18:54:19 by 阳光8619
[MS] [已完结]溶剂效应 (2/526) 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 (0/1361) budgerigar 2012-03-03 2012-03-03 16:36:24 by budgerigar
[LAMMPS/ ] 【讨论】dlpoly能量不收敛 (3/1558) yy10841010 2010-04-25 2012-03-03 15:52:49 by ohnesie
[DS/Syby ] [已完结][关贴]sybyl在 SYBYL中,做COMFA 时候 怎么改那个晶体格的步长呢 (1/575) 游子8921 2012-03-02 2012-03-03 12:51:20 by win雨
[MS] [已完结]MS安装出错 (3/607) 717414324 2012-01-07 2012-03-03 12:38:30 by w76990480
[MS] [已完结]分子模拟求助 (0/282) 717414324 2012-03-03 2012-03-03 11:01:40 by 717414324
[其他] [已完结]相场模拟结果怎么可视化,有没有可用的软件? (1/1378) Knight2026 2012-02-29 2012-03-03 00:53:01 by liverangel
[专家会诊] [已完结]有关集合变量的问题讨论 (0/560) dreamtiger 2012-03-02 2012-03-02 20:26:22 by dreamtiger
[MS] 分子模拟太难了!搞不下去    ( 1 2 3 4 5 6 .. 7 ) (60/5590) veinxuyang 2012-01-09 2012-03-02 19:26:36 by Tanya_snail
[LAMMPS/ ] [已完结]dl_poly的Ryckaert Bellemans二面角参数在哪里设置 (0/587) beieib 2012-03-02 2012-03-02 17:19:03 by beieib
[DS/Syby ] [已完结]蛋白等电点预测 (0/406) lifei_dut 2012-03-02 2012-03-02 15:14:58 by lifei_dut
[Monte C ] [已完结]用music软件时molec/uc如何换算成mmol/g (5/2304) 王慧1021 2012-02-24 2012-03-02 14:49:20 by 王慧1021
[MS] ms计算的配置 (5/737) yingwu528 2012-03-01 2012-03-02 14:18:01 by yingwu528
[其他] [已完结][关贴]求吉林大学CALYPSO晶体结构预测软件! (4/1746) weiyongkai 2012-03-01 2012-03-02 13:11:38 by weiyongkai
[LAMMPS/ ] [已完结]lammps能用TIP4P/ICE来算冰吗 (5/1724) cmkk 2012-02-25 2012-03-02 10:58:25 by qphll
[Gromacs ] [已完结][关贴]gromacs 模拟的一个条件判断 (2/593) jiaoyixiong 2012-03-01 2012-03-02 10:46:56 by qphll
[Gromacs ] [已完结]AMBER算高分子怎么用啊? (1/346) 903566945 2012-03-02 2012-03-02 10:43:22 by caixin5120
[MS] [已完结]新手急求如何用MS建立(002)取向的ZnO晶体模型 (2/1426) djf0911ok 2012-02-26 2012-03-02 09:43:20 by djf0911ok
[Monte C ] [已完结]蒙特卡洛模拟的软件可以计算的性质求助 (1/1302) lxmn 2012-03-01 2012-03-02 09:20:09 by qphll
[DS/Syby ] [已完结][关贴]配体sd文件 (3/1060) 家强 2012-02-18 2012-03-02 07:55:14 by yalefield
[MS] [已完结]请教如何利用materials studio建立任意晶界的双晶模型 (2/1642) phoenix.zluo 2012-02-29 2012-03-02 00:13:20 by m0626
[其他] [已完结]力场与多体势分别指什么?    ( 1 2 ) (10/1804) hongsemenghuan 2012-02-27 2012-03-01 22:00:52 by chaizhm
[LAMMPS/ ] [已完结]求有经验的DL_POLY模拟BaTiO3铁电相变高手 (2/590) iamikaruk 2011-11-16 2012-03-01 17:29:13 by iamikaruk
[MS] [已完结][关贴]Materials-studio 4.4键模中遇到问题 (0/356) zxl523 2012-03-01 2012-03-01 11:22:39 by zxl523
[DS/Syby ] [已完结]生成药效团时,化合物的手性问题 (7/2098) win雨 2012-02-27 2012-03-01 10:35:51 by arthurii
[MS] [已完结][关贴]求Materials-studio 4.4使用说明 (0/271) zxl523 2012-03-01 2012-03-01 10:13:37 by zxl523
[DS/Syby ] [已完结]用DS做QSAR pharmacophore (3/1268) shaye 2011-11-04 2012-03-01 10:10:29 by shaye
[MS] [关贴]建模中出现的问题~~~~ (7/1381) zxl523 2012-02-29 2012-03-01 08:59:47 by zxl523
[LAMMPS/ ] [已完结]Lammps里面如何使用fene (7/2986) chaonie 2012-02-28 2012-03-01 08:33:37 by jiaoyixiong
[MS] [已完结]请问两个磷脂分子的范德华势能如何求 (4/1059) qie0559 2012-02-29 2012-02-29 23:47:24 by qie0559
[MS] [关贴]emim-tf2n的密度 (2/698) zxl523 2012-02-16 2012-02-29 16:08:26 by zxl523
[Monte C ] [已完结]DSMC中能否用Larsen-Borgkke处理非平衡气体的内能和平动能间的交换 (1/492) jc2006 2012-02-28 2012-02-29 14:48:17 by bigfeather29
[LAMMPS/ ] [已完结]lammps 怎么加载模拟外作用力是三角波形式 (0/589) shielia 2012-02-29 2012-02-29 10:20:38 by shielia
[专家会诊] [已完结]问下monte Carlo模拟中LJ势能参数(求助) (0/614) xiyi1985 2012-02-28 2012-02-28 21:03:54 by xiyi1985
[MS] [已完结]MS中提取粘度参数 (0/440) 沁园春·雪 2012-02-28 2012-02-28 16:20:40 by 沁园春·雪
[Gromacs ] [已完结]Anal模块 (0/245) ww5945 2012-02-28 2012-02-28 13:53:24 by ww5945
[MS] 求助:模拟碳纳米管受冲击发生失稳。    ( 1 2 ) (11/1838) juwendy 2011-12-21 2012-02-28 11:52:16 by juwendy
[Gromacs ] [已完结][关贴]AMBER11安装问题 (0/245) 903566945 2012-02-28 2012-02-28 11:37:08 by 903566945
[专家会诊] [已完结]求助:用什么词可以描述环状多肽与侧链负电基团的距离 (0/289) china.changmm 2012-02-28 2012-02-28 08:58:52 by china.changmm
[MS] [已完结]甲基(CH3)怎么建模? (1/577) xieluxielu 2012-02-27 2012-02-28 08:42:37 by jiaoyixiong
[LAMMPS/ ] DL_PLOY 中所需要FIELD文件中的参量如何设置? (1/397) slz_1018 2012-02-26 2012-02-28 00:51:42 by ohnesie
[MS] [已完结]用MS计算草酸钙晶体的表面能 (模拟EPI+1)(1/748) hmilycat1314 2012-02-27 2012-02-27 21:55:25 by chaizhm
[Gromacs ] [已完结]Gromacs怎么得到 Distribution of spherical cavities (1/425) 小白如水 2012-02-27 2012-02-27 13:21:40 by 小白如水
[MS] [已完结]如何用MS计算σ-图谱 (1/651) ljing131 2012-02-22 2012-02-27 09:17:22 by ljing131
[DS/Syby ] 【讨论】COMFA计算的主成分问题 (评阅+1) (7/1975) lvjuanhuhu 2010-12-05 2012-02-27 08:23:15 by 芒小果乐园
[MS] [已完结][关贴]NaY分子筛调节Si/Al比后产生的问题? (4/1305) premonkey 2012-02-25 2012-02-26 19:32:50 by premonkey
[专家会诊] [已完结]做完ligand和蛋白的对接后如何跑一个动力学模拟,看看ligand和周围残基的小幅度变化? (6/1393) pkuchemistry 2011-12-08 2012-02-26 11:24:33 by 蒙延娟
[MS] [已完结]求助ms分子模拟 (4/1188) 轼之 2012-02-23 2012-02-25 15:10:15 by zhl98
[DS/Syby ] [已完结]AUTODOCK对接步骤求助(附图) (7/2537) 可米kemi 2011-09-05 2012-02-25 13:40:43 by gouyi
[专家会诊] [已完结]小白求助FDTD做拉曼方面信息 (0/544) Me_反物质 2012-02-25 2012-02-25 10:44:06 by Me_反物质
[专家会诊] [已完结]请教一个过渡态问题。 (0/323) hyxion 2012-02-24 2012-02-24 23:34:50 by hyxion
[DS/Syby ] [已完结]DS 做分子对接 (3/3290) sunmuer 2012-02-24 2012-02-24 19:24:33 by hyb181117
[LAMMPS/ ] [已完结]centro/atom缺陷还是完好 的 判断 (0/681) lbbz323 2012-02-24 2012-02-24 17:47:05 by lbbz323
[DS/Syby ] [已完结][关贴]关于sybyl中的Topomer Search问题 (0/1076) 秋天的思念 2012-02-24 2012-02-24 17:10:12 by 秋天的思念
[MS] [已完结]怎么建立SDB(苯乙烯和二乙烯苯的聚合物)的模型 (0/687) 2006201619 2012-02-24 2012-02-24 17:06:07 by 2006201619
[其他] 请问Chem3d问题 (3/1876) liuqiang2270 2012-02-20 2012-02-24 14:10:44 by liuqiang2270
[Gromacs ] [已完结]弱弱的问:如果蛋白不补齐,可以跑动力学模拟吗? (1/407) lovedi 2012-02-21 2012-02-24 13:29:52 by ferlich
[MS] [已完结]Ms如何建立复杂层板模型? (2/640) may_gloomy 2011-11-22 2012-02-24 09:26:03 by xiaoconcon
[DS/Syby ] [关贴]ds中的分子优化 (5/2467) 家强 2012-02-23 2012-02-24 09:23:30 by 家强
[MS] [已完结]还是求助,用径向分布函数求配位数的方法。 (3/2007) herarysara 2012-02-23 2012-02-24 09:10:16 by herarysara
[DS/Syby ] [已完结]DS 中定义蛋白质为受体失败 (2/536) 虎虎猪 2012-02-23 2012-02-24 08:38:56 by blue_cat
[MS] [已完结]VMD 使用求助 (1/775) xudi1127 2012-02-24 2012-02-24 08:20:31 by jiaoyixiong
[MS] [已完结]求助EQ3/6软件包(Wolery,1992)中cmp数据库中的热力学参数 (0/811) dujuan247 2012-02-23 2012-02-23 22:22:34 by dujuan247
[Gromacs ] [已完结]粗粒金纳米颗粒参数设置 (0/530) 明月照清渠 2012-02-23 2012-02-23 21:16:16 by 明月照清渠
[DS/Syby ] 【原创】sybyl windows版资源 (13/3106) mike0601 2010-04-07 2012-02-23 19:48:09 by 游子8921
[MS] [已完结]求助,MS中怎么计算聚合物的力学性能,谢谢 (0/847) champion939 2012-02-23 2012-02-23 17:25:57 by champion939
[MS] [已完结][求助] 构象等高图,非常感谢 (0/295) champion939 2012-02-23 2012-02-23 16:54:38 by champion939
[MS] [已完结]急求两个反应产生的三水碳酸镁和414的碱式碳酸镁的△G (4/1289) dujuan247 2012-02-23 2012-02-23 16:19:00 by dujuan247
[LAMMPS/ ] 现行lammps中的DPD能处理带电体系吗? (0/765) ghy8879 2012-02-23 2012-02-23 15:12:52 by ghy8879
[MS] [已完结]请高手指教怎样用Ms构建重合点阵(CSL)或O点阵界面模型? (0/1246) liyangsdu 2012-02-23 2012-02-23 15:00:04 by liyangsdu
[LAMMPS/ ] [已完结]出现这种错误是什么原因 (0/359) 5432love 2012-02-23 2012-02-23 14:21:43 by 5432love
[其他] [已完结]对称分子在ATK软件模拟计算下I-V曲线不对称是什么原因?最好能提供相关文献 (1/358) zhang-hang 2012-02-21 2012-02-23 14:05:06 by zhang-hang
[Gromacs ] [已完结]关于amber动力学模拟中MM/GBSA的问题 (7/3711) haiyanqian 2012-02-15 2012-02-23 11:00:54 by haiyanqian
[专家会诊] [已完结]多肽化合物的docking (5/1540) wang-yuan 2012-02-21 2012-02-23 10:25:00 by wang-yuan
[Monte C ] 【讨论】什么叫小尺寸效应 (6/2355) mljphy 2010-04-25 2012-02-23 07:59:36 by luoguoqiang
[LAMMPS/ ] [已完结]rebo势函数相关 (1/1255) superstamina 2012-02-09 2012-02-22 23:04:37 by lijun_2550
[其他] Ph.D scholarship in Computational Biology, Nanyang Tech. Univ. at Singapore (1/455) llyllylly 2012-02-22 2012-02-22 22:55:13 by leo1252
[DS/Syby ] [已完结]有将两个配体分子同时对接到蛋白质中的软件吗? (1/1224) docknewman 2012-02-17 2012-02-22 21:12:40 by renxudong
[MS] [已完结]帮忙看看审稿意见:有关分子动力学模拟解释蛋白与底物相互作用 (3/1496) tuwenwuguan 2012-02-21 2012-02-22 21:01:16 by tuwenwuguan
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