normal seq2itp.pl

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12 years 5 months ago - 12 years 5 months ago #818 by 55
seq2itp.pl was created by 55
In fact, H (i.e. HIS i.e. Histidine) ought to have a charge +1.

But in the seq2itp.pl, H => 0.0 , as follows:

# charges
our %q_hash = (
G => 0.0, A => 0.0, D =>-1.0, N => 0.0, E =>-1.0, Q => 0.0, V => 0.0,
L => 0.0, I => 0.0, M => 0.0, T => 0.0, S => 0.0, C => 0.0, K => 1.0,
R => 1.0, H => 0.0, F => 0.0, P => 0.0, W => 0.0, Y => 0.0);

So, should I change H => 0.0 to H => 1.0 ?

thanks so much !
Last edit: 12 years 5 months ago by .

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12 years 5 months ago #819 by djurre
Replied by djurre on topic seq2itp.pl
Dear Gaobo Yu,
I'm affraid I don't understand your question.

Groetnis,
Djurre

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