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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: 1,978
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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