readme~

来自「c++编写的并行拉马克遗传算法的程序。实现分析对接程序」· 代码 · 共 18 行

To run addsol: 
	1:compile it "cc -o addsol addsol.c"
	2: run "addsol yourfile.pdbq yourfile.pdbqs"
	
addsol appends solvation parameters to the protein pdbq file starting in columns 76,
addsol has hardwired parameters which could be changed only be changing addsol.c

NB: 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 not
clear what value should be assigned for OXT (????)


		-rh, 1/8/98