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小木虫论坛-sci期刊点评专栏:拥有来自国内各大院校、科研院所的博硕士研究生和企业研发人员对期刊的专业点评,覆盖了8000+ sci期刊杂志的专业点评信息,为国内外学术科研人员论文 … Unrecognized atom style full is part of the molecule package which is not enabled in this lammps binary. In biochemistry, the term is applied to the three conventional biopolymers (nucleic … 二、tsms(ture single molecule sequencing) helicos bioscience (ma, usa) 于2008年推出的heliscope单分子测序平台被认为是第一个商品化的第三代测序仪。 Opt_iterations 100 scf_iterations 50 这两个都太小了,都设置到1000。不知道你用的啥版本,有的版本收敛很不好, 如图,gaussian结构优化完成之后打开output文件时出现failure reading molecule specification, 无法查看分子构型,但可以打开结果的文本文档,这是为什么?求助~ 无标题. png 返回小木虫查 … 我是namd的初学者,按一个教程在学习,当人工制作泛素psf文件时, 打入命令: source ubq. pgn后 出现以下提示, too many arguments specified molecule destroyed by … A macromolecule is a very large molecule commonly created by polymerization of smaller subunits. (. /atom. cpp:509) 在安装软件包时已经将molecule package安装上,输入make … Bonds defined but no bond types (. /read_data. cpp:1121), 手册上说是data文件中,文件头列出了bond但是没有bond类型。可是我在in文件里已经给出 …