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Semiempirical NDDO

Dynamicnodes version 20.4.144.202011111133 by SCHRODINGER

Set up and run a semiempirical calculation on one or more structures using the semiempirical NDDO module

Backend implementation

"${SCHRODINGER}/run" semi_emp.py

Input Ports

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Input in Maestro, Sdf or Mol2

Output Ports

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Output in Maestro

Views

Log output

Installation

To use this node in KNIME, install Schrödinger Extensions for KNIME from the following update site:

KNIME 4.2

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Developers

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