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To compile addsol:------------------(1) At the Unix prompt, type "cc -o addsol addsol.c"To run addsol: --------------(2) run "addsol yourfile.pdbq yourfile.pdbqs" addsol appends solvation parameters to the protein pdbq file starting in columns 76, addsol has hard-wired parameters which can be changed only by changing addsol.cNB: The output of this program differs from that of addsol.f in the assignment of parameters to atom of the following types: CA HE2[2 or 1] GLN OXT CYS in the first case, the proper value is assigned by the c-code whereas it is notclear what value should be assigned for OXT. -rh, 1/8/98
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