#!/bin/tcsh echo Converting ZINC molecule database to be compatible with Dock 4, echo do not close this window echo start at date sed -e "s/ 0 0 0/ 1 0 0/g" -e "/@ATOM/ i\\ " -e "/BOND/,/MOLECULE/s/@MOLECULE/@SUBSTRUCTURE\\ 1 **** 1 TEMP 0 **** **** 0 ROOT \\ @MOLECULE/g" $1>gzt$1 cat gzt$1 add_info>ok_$1 rm gzt$1 echo finished at date echo Convertion Completed!