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    Multiwfn official website: http://www.shanxitv.org/multiwfn. Multiwfn forum in Chinese: http://bbs.keinsci.com/wfn

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    #1 2025-04-28 16:49:49

    Sailendra Pradhan
    Member
    Registered: 2025-04-28
    Posts: 1

    EDA analysis for host:guest system

    HI everyone,
    Can anyone please help me to setup the file for EDA analysis of host:guest complexes?

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    #2 2025-04-28 18:01:26

    sobereva
    Tian Lu (Multiwfn developer)
    From: Beijing
    Registered: 2017-09-11
    Posts: 2,011
    Website

    Re: EDA analysis for host:guest system

    If you refer to sobEDA, there is no special point for host:guest system, just treat it as a molecular dimer.

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