IQmol

IQmol is a easy to use molecular editor and visualization package with the ability to connect to remote servers to run ab initio calculations.
Find IQmol at: http://iqmol.org

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1 Response to IQmol

  1. surya says:

    How efp fragments are put around solute in Iqmol. what must be the least distance of epf fragments from QM part and how many fragment shall i try at a time? Does orientation of EFP fragement affect effective fragment potential?
    How can i get correct Efp fragments to surround around QM section of solute?

    surya

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