About this class
Advanced Computational Chemistry
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Learning Material
Title
Volume
Unit 1: Quantum Chemistry Methods for Excited States
5.89 MB
<p>Quantum Chemistry Methods for Excited States</p>
Unit 2: Molecular Dynamics Simulations of Biomolecules
5.89 MB
<p>Molecular Dynamics Simulations of Biomolecules</p>
Unit 3: Density Functional Theory (DFT) for Solids and Surfaces
5.89 MB
<p>Density Functional Theory (DFT) for Solids and Surfaces</p>
Unit 4: Ab Initio Molecular Orbital Theory
5.89 MB
<p>Ab Initio Molecular Orbital Theory</p>
Unit 5: Machine Learning in Computational Chemistry
5.89 MB
<p>Machine Learning in Computational Chemistry</p>
Non-Equilibrium Molecular Dynamics
5.89 MB
<p>Non-Equilibrium Molecular Dynamics</p>
Chemoinformatics and Virtual Screening
5.89 MB
<p>Chemoinformatics and Virtual Screening</p>
Computational Studies of Reaction Mechanisms
5.89 MB
<p>Computational Studies of Reaction Mechanisms</p>
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