ac是自相关函数本身，lifetime是基于ac进一步算出来的量，含义不同
一下为终端输出信息：Command line:gmx hbond -f ../md.xtc -s ../md.tpr -num -ac -life -...
The input file can be taken directly from gmx hbond -ac, and then the same result should be produced. Option -fitfn performs curve fitting to a number of different curves that make sense in the context of molecular dynamics, mainly exponential curves. More information is in the manual. To...
gmx hbond [-f[<.xtc/.trr/...>]] [-s[<.tpr>]] [-n[<.ndx>]] [-num[<.xvg>]] [-g[<.log>]] [-ac[<.xvg>]] [-dist[<.xvg>]] [-ang[<.xvg>]] [-hx[<.xvg>]] [-hbn[<.ndx>]] [-hbm[<.xpm>]] [-don[<.xvg>]] [-dan[<.xvg>]] [-life[<.xvg>]] [-nhb...
GROMACS氢键分析工具hbond的使用及扩展 使用gnuplot绘制氢键数据的平行轴图 gmx_hbdat.bsh hbdat_1crn.zip remd_tgenerator