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Program of Study: Chemistry
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Discipline: Computational chemistry
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Electronic Theses & Dissertations
12
Material Type
Theses
12
Language
English
12
Copyright Status
Creative Commons Licensed
6
In Copyright
6
Subject
Biochemistry
2
Biophysics
1
Biradicals
1
Chemical bonds
1
Chemistry, Organic
1
Chemistry, Physical and theoretical
1
Chemistry--Computer simulation
3
Computational biology
1
Cytology--Computer simulation
1
DNA--Computer simulation
1
Density functionals
1
Electronic structure
1
Homogeneous catalysis
1
Hydrogen bonding
1
Imaging systems in medicine
1
Machine learning
1
Many-body problem--Numerical solutions
1
Medical microscopy
1
Molecular dynamics
2
Molecular dynamics--Computer simulation
1
Molecular dynamics--Mathematical models
1
Multiphoton excitation microscopy
1
Nanoscience
1
Photochemistry
1
Photochemistry--Research
1
Potential energy surfaces
1
Potential theory (Mathematics)
1
Protein folding--Computer simulation
1
Quantum chemistry
3
Quasimolecules
1
Spectrum analysis
1
Transition metal ions
1
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Molecular photochemistry at the nanoscale and developments towards modeling nonadiabatic dynamics on many electronic states
Esch, Michael Paul
Text (2020)
Part of
Electronic Theses & Dissertations
Collision-induced absorption of hydrogen containing systems
Lee, Hua-Kuang
Text (2020)
Part of
Electronic Theses & Dissertations
Ion parametrization in water-ligand systems
Li, Zhen
Text (2023)
Part of
Electronic Theses & Dissertations
Computational Molecular Design and Innovation : from Drug Discovery to Emerging Contaminants
Eken, Yigitcan
Text (2021)
Part of
Electronic Theses & Dissertations
Deterministic and semi-stochastic cc(p ; q) approaches : new developments and applications to spectroscopy and photochemistry
Yuwono, Stephen Haniel
Text (2022)
Part of
Electronic Theses & Dissertations
Simulating the chelate effect and the molecular dynamics of transition metal ions
Seitz, Anthony Joseph
Text (2020)
Part of
Electronic Theses & Dissertations
Machine learning for pose selection
Pei, Jun (Graduate of Michigan State University)
Text (2020)
Part of
Electronic Theses & Dissertations
The integration of computational methods and nonlinear multiphoton multimodal microscopy imaging for the analysis of unstained human and animal tissues
Murashova, Gabrielle Alyse
Text (2019)
Part of
Electronic Theses & Dissertations
Highly accurate potential energy surfaces for the He-H2 interacting system
Bradley, Janelle A.
Text (2018)
Part of
Electronic Theses & Dissertations
Assessment of equation-of-motion coupled-cluster methods with approximate treatments of higher-order excitations and development of novel schemes for accurate calculations of diradical electronic spectra and bond breaking
Ajala, Adeayo Olayinka
Text (2017)
Part of
Electronic Theses & Dissertations
Development and application of effective quantum chemical strategies
Patel, Prajay
Text (2019)
Part of
Electronic Theses & Dissertations
Multiscale modeling of nucleic acids in cellular environments
Yildirim, Asli
Text (2017)
Part of
Electronic Theses & Dissertations
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