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How to do molecular orbital analysis to find d-orbitals involved in bonding in an organometallic compound?

Structure modeling of chemical compounds finds essential application in the field of cheminformatics. It is used to study the structural stability, metal-ion bonding, the presence of electrons, closed and open shell energies, the reactivity of complexes, molecular orbital analyzes, molecular mechanics, and so on. There is some software available for structural modeling of chemical compounds/complexes and the most widely used are Gaussian [1] and ORCA [2]. Continue reading “How to do molecular orbital analysis to find d-orbitals involved in bonding in an organometallic compound?” »

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Geneious: A platform for Comprehensive Analysis and Organization of Genes

The two main functions of bioinformatics are the organization and analysis of biological data using computational resources. Geneious is designed to be an easy-to-use and flexible desktop software application framework for the organization and analysis of biological data, with a focus on molecular sequences and related data types. It integrates numerous industry-standard discovery analysis tools,… Keep Reading

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