manual.29.html

来自「最经典的分子对结软件」· HTML 代码 · 共 22 行

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<!DOCTYPE HTML PUBLIC "-//W3C//DTD HTML EXPERIMENTAL 970324//EN"><HTML><HEAD><META NAME="GENERATOR" CONTENT="Adobe FrameMaker 5.5/HTML Export Filter"><LINK REL="STYLESHEET" HREF="Manual.css"><TITLE> conect</TITLE></HEAD><BODY BGCOLOR="#ffffff"><H2 CLASS="Heading-3"><A NAME="pgfId=3331"> </A><A NAME="marker=14948"> </A>conect</H2><P CLASS="Body"><A NAME="pgfId=3335"> </A>Author:		Elaine Meng</P><P CLASS="Body"><A NAME="pgfId=3339"> </A>conect is an interactive program that appends conect records to a pdb file containing the coordinates of a single molecule. The user is prompted for the names of the input and output files. The presence of a bond is determined as follows:  two atoms are bonded if the distance between them is less than or equal to the sum of their covalent bond radii plus a tolerance of 0.4 Angstroms.</P><CENTER><P>

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