Simulation w/ Metal ion

Tae-Joon Kwon linusben at biopia.snu.ac.kr
Mon May 4 04:27:06 EST 1998


I'd like to simulate the bio-adsorption of heavy metal.

Almost all simulation programs, not only freewares but commercial ones,
can be shown the binding of small molecules (ligand), I think.

But, how about heavy metal rather than ligand?
Can I calculate the binding energy of Metal with biomolecule?

Notice the techniques or the program tools, Anything OK...


linusben at biopia.snu.ac.kr

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