From: Pascal M. <pas...@gm...> - 2009-11-26 15:38:55
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> Going by the man page (hint hint) @ http://openbabel.org/wiki/Babel, > perhaps --title "" would help. Right. Doing babel --title "" --append ", ID EC50" file.sdf new.sdf generate this kind of title: ,ID,6.63 It's OK, but, for me, the beginning comma is undesirable. But yes, it's needed if the replacing title is not empty... By the way, may "_" be considered as a punctuation character, which could be used as the separator for --append? Would clash with the space/_ in the property name, isn't it? Regards, Pascal |