Number of items: 78.
2024
Korol, Roman
(2024)
Development and Applications of Imaginary Time Path Integral Methods.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/jy10-rf87.
https://resolver.caltech.edu/CaltechTHESIS:08212023-205141057
2023
Lawniczak, James Joseph
(2023)
Computational Investigations of Organometallic Catalysis.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/aepb-jm46.
https://resolver.caltech.edu/CaltechTHESIS:08042022-183527205
Qiao, Zhuoran
(2023)
Physics-Informed Neural Approaches for Multiscale Molecular Modeling and Design.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/48d1-ja21.
https://resolver.caltech.edu/CaltechTHESIS:12102022-055022458
2022
Tao, Xuecheng
(2022)
Capturing Nuclear Quantum Effects at Classical Efficiency: a Path-Integral Approach.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/s929-5x12.
https://resolver.caltech.edu/CaltechTHESIS:03282022-213805038
Aceves, Aiden Joseph
(2022)
Machine Learning and Modeling Methods for Protein Engineering.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/5j34-0d55.
https://resolver.caltech.edu/CaltechTHESIS:09092021-024951318
Cheng, Lixue
(2022)
Accurate and Transferable Molecular-Orbital-Based Machine Learning for Molecular Modeling.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/cjak-4x38.
https://resolver.caltech.edu/CaltechThesis:04012022-153013173
Fornace, Mark Evan
(2022)
Computational Methods for Simulating and Parameterizing Nucleic Acid Secondary Structure Thermodynamics and Kinetics.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/ayeg-at42.
https://resolver.caltech.edu/CaltechTHESIS:12212021-202554260
Jacobson, Daniel Rance
(2022)
Computational Studies of Dendritic Deposition and Trajectory Phase Coexistence.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/dje7-ey77.
https://resolver.caltech.edu/CaltechTHESIS:05272022-201237457
Kim, Jeongmin
(2022)
Molecular Simulations of Charge Transport for Energy Storage and Conversion Applications.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/5haz-ch54.
https://resolver.caltech.edu/CaltechTHESIS:08202021-200738765
Rosa-Raíces, Jorge Luis
(2022)
Path Space Markov Chain Monte Carlo Methods for Molecular Simulation.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/10jr-hg67.
https://resolver.caltech.edu/CaltechTHESIS:03292022-234015177
Schild, Dirk Jacob
(2022)
Synthesis, Characterization, and Reactivity of Iron Hydrides in Nitrogen Fixation and Proton Coupled Electron Transfer from C-H bonds.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/1ytm-7s85.
https://resolver.caltech.edu/CaltechTHESIS:10192021-161648176
Zimmer, Matthew Holden
(2022)
Cotranslational Pulling Forces Alter Outcomes of Protein Synthesis.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/p7vk-cf03.
https://resolver.caltech.edu/CaltechTHESIS:07232021-171251780
2021
Dulaney, Austin Ryan
(2021)
Density Fluctuations and Machine Learning in Active Matter.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/ne1a-je31.
https://resolver.caltech.edu/CaltechTHESIS:12282020-233314685
Lee, Sebastian James Rice
(2021)
Combining High- and Low-Level Electronic Structure Theories for the Efficient Exploration of Potential Energy Surfaces.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/saf3-j798.
https://resolver.caltech.edu/CaltechTHESIS:10292020-175326058
Mead, Griffin John
(2021)
Chirped Pulse Microwave and Single-Shot Terahertz Spectroscopy Studies of Intermolecular Interactions.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/7wzt-ak58.
https://resolver.caltech.edu/CaltechTHESIS:12072020-235133438
Nuñez, Paul Daniel
(2021)
Investigating Unexpected but Advantageous Integrated Systems for Solar Water Splitting.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/8q5x-9d27.
https://resolver.caltech.edu/CaltechTHESIS:01162020-234409466
Sun, Chong
(2021)
Finite Temperature Simulations of Strongly Correlated Systems.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/dchn-p020.
https://resolver.caltech.edu/CaltechTHESIS:12102020-032212115
Xie, Hao
(2021)
Road to Equilibrium: Stable Isotope Distribution in Gaseous Alkanes and Thermal History of Geological Hydrocarbons.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/neh6-6c82.
https://resolver.caltech.edu/CaltechTHESIS:04012021-045507416
2020
Chalkley, Matthew J.
(2020)
Proton-Coupled Electron Transfer in Nitrogen Fixation.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/FE9D-9K14.
https://resolver.caltech.edu/CaltechTHESIS:02052020-203503014
Davis, Hunter Cole Davis
(2020)
Mechanistic Insights for Magnetic Imaging and Control of Cellular Function.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/9QEJ-6H55.
https://resolver.caltech.edu/CaltechTHESIS:10072019-141728052
Fajardo, Javier, Jr.
(2020)
Transition Metal Complexes for Challenging Reductive Transformations: From Nitrogen Fixation Catalysts to Photoreductants.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/0fgd-j835.
https://resolver.caltech.edu/CaltechTHESIS:06082020-141438135
Krueger, Rachel Ann
(2020)
Theoretical Characterization of Aromatic Exciplex Fluorescence.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/FW2R-BF41.
https://resolver.caltech.edu/CaltechTHESIS:07242019-140324087
Lunny, Elizabeth Margaret
(2020)
High-Resolution Photoacoustic Spectroscopy of the Oxygen A-Band.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/qxcm-4909.
https://resolver.caltech.edu/CaltechTHESIS:06082020-132244698
2019
Hannoun, Kareem Imad
(2019)
Mechanistic Study of Cu-Mediated, Photoinduced C–S Bond Formation and Demonstration of Electrochemical Ammonia Production by a Surface-Attached Iron Complex.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/R9EJ-KX83.
https://resolver.caltech.edu/CaltechTHESIS:05302019-070503222
Ho, Samuel Hin-Yuen
(2019)
Chemical Tools for Protein Imaging in Live Bacterial Cells.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/KNWF-CZ96.
https://resolver.caltech.edu/CaltechTHESIS:05312019-211114775
Huang, Yufeng
(2019)
Computational Heterogeneous Electrochemistry – From Quantum Mechanics to Machine Learning.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/MCGV-Y790.
https://resolver.caltech.edu/CaltechTHESIS:12232018-185711169
Hui, Aileen Oyama Ah Yee
(2019)
Atmospheric Peroxy Radical Chemistry Studied by Infrared Kinetic Spectroscopy.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/Z9H0-1H20.
https://resolver.caltech.edu/CaltechTHESIS:01172019-135430092
Hwang-Fu, Yu-Hsien
(2019)
Dynamic Regulations of Co-Translational Protein Targeting by the Signal Recognition Particle Receptor in E. coli and Human.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/STGW-8V12.
https://resolver.caltech.edu/CaltechTHESIS:12122018-102847326
Shen, Kevin
(2019)
Conformations and Charge Fluctuations in Polyelectrolyte Solutions.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/Y6VG-0297.
https://resolver.caltech.edu/CaltechTHESIS:08142018-105206326
2018
Kim, Jungwoo
(2018)
Microfluidic Analysis in Patient Biopsies: toward Precision Medicine for Glioblastoma Multiforme.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/Z9639MX2.
https://resolver.caltech.edu/CaltechTHESIS:09042017-140704721
Marshall, Stephen Sandell
(2018)
Improvement of Integral Membrane Protein Expression via Optimization of Simulated Integration Efficiency.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/Z9Q23XD3.
https://resolver.caltech.edu/CaltechTHESIS:08292017-151537318
Matson, Benjamin David
(2018)
Interplay of Proton Transfer, Electron Transfer and Proton-Coupled Electron Transfer in Transition Metal Mediated Nitrogen Fixation.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/Z9MS3R0Z.
https://resolver.caltech.edu/CaltechTHESIS:02232018-152758526
Niesen, Michiel Jacobus Maria
(2018)
Coarse-Grained Simulation Approaches for Protein Integration and Translocation via the Sec Translocon.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/Z91N7ZBS.
https://resolver.caltech.edu/CaltechTHESIS:04052018-112428695
Zwang, Theodore Joseph
(2018)
Magnetic Field Effects and Biophysical Studies on DNA Charge Transport and Repair.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/Z9TT4P4H.
https://resolver.caltech.edu/CaltechTHESIS:07282017-141924517
2017
Finneran, Ian Alan
(2017)
Terahertz and Microwave Spectroscopy of Liquids and Hydrogen-Bonded Clusters.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/Z9348HD4.
https://resolver.caltech.edu/CaltechTHESIS:03082017-151032634
Hong, Yun-Hua
(2017)
Theory of Dynamical Processes in Semiconductor Quantum Dots.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/Z99G5JT3.
https://resolver.caltech.edu/CaltechTHESIS:08102016-154641607
Xu, Chen
(2017)
The Catalytic and Mechanical Properties of Lithium Battery Electrodes.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/Z9XG9P4W.
https://resolver.caltech.edu/CaltechTHESIS:11062016-104329889
Zhuang, Bilin
(2017)
Dipolar Liquids and Their Mixtures: Equilibrium and Nonequilibrium Properties with Field-Theoretic Approaches.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/Z9VQ30QR.
https://resolver.caltech.edu/CaltechTHESIS:06042017-233656614
2016
Chen, David Zhaoyue
(2016)
Atomic-Level Structure and Deformation in Metallic Glasses.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/Z95Q4T2B.
https://resolver.caltech.edu/CaltechTHESIS:05252016-155624343
Forte, Lila
(2016)
Statistical Mechanical Framework for Predicting Cellular Response.
Master's thesis, California Institute of Technology.
doi:10.7907/Z9K07273.
https://resolver.caltech.edu/CaltechTHESIS:05272016-101847646
Wang, Connie Yuan-Ying
(2016)
Understanding Co-Translational Protein Targeting and Lithium Dendrite Formation through Free Energy Simulations and Coarse-Grained Models.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/Z97H1GHF.
https://resolver.caltech.edu/CaltechTHESIS:05232016-092808469
Webb, Michael Anthony
(2016)
Path-Integral and Coarse-Graining Strategies for Complex Molecular Phenomena.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/Z90Z7172.
https://resolver.caltech.edu/CaltechTHESIS:05252016-213050706
2015
Allodi, Marco Alberto
(2015)
On Ultrafast Time-Domain TeraHertz Spectroscopy in the Condensed Phase: Linear Spectroscopic Measurements of Hydrogen-Bond Dynamics of Astrochemical Ice Analogs and Nonlinear TeraHertz Kerr Effect Measurements of Vibrational Quantum Beats.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/Z97D2S2P.
https://resolver.caltech.edu/CaltechTHESIS:05312015-221615628
Barnes, Taylor Arnold
(2015)
Development and Application of Embedding Methods for the Simulation of Large Chemical Systems.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/Z9KK98P1.
https://resolver.caltech.edu/CaltechTHESIS:04212015-084744168
Cvicek, Vaclav
(2015)
Structure Prediction of G-Protein Coupled Receptors.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/Z9S46PVG.
https://resolver.caltech.edu/CaltechTHESIS:02042015-031802985
Farwell, Christopher C.
(2015)
Engineering and Characterization of Cytochrome P450 Enzymes for Nitrogen-Atom Transfer Reactions.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/Z9765C71.
https://resolver.caltech.edu/CaltechTHESIS:01302015-155404718
Hong, Qi-Jun
(2015)
Methods for Melting Temperature Calculation.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/Z98C9T6H.
https://resolver.caltech.edu/CaltechTHESIS:11092014-074023936
Kirkpatrick, Andrea
(2015)
Computational Predictions of G Protein-Coupled Receptor Structures and Binding Sites.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/Z9NG4NJG.
https://resolver.caltech.edu/CaltechTHESIS:04132015-220841374
Kretchmer, Joshua S.
(2015)
Direct Simulation of Proton-Coupled Electron Transfer Reaction Dynamics and Mechanisms.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/Z98913T5.
https://resolver.caltech.edu/CaltechTHESIS:01202015-085910230
Marotta, Christopher Bruno
(2015)
Structure-Function Studies of Nicotinic Acetylcholine Receptors Using Selective Agonists and Positive Allosteric Modulators.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/Z9V122Q9.
https://resolver.caltech.edu/CaltechTHESIS:05292015-144036736
Wang, Rui
(2015)
Effects of Self Energy of the Ions on the Double Layer Structure and Properties at the Dielectric Interface.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/Z9DN431P.
https://resolver.caltech.edu/CaltechTHESIS:12102014-125310289
Weitekamp, Raymond Andrew
(2015)
Multifunctional Materials: Bottom-Up and Top-Down.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/Z90C4SSB.
https://resolver.caltech.edu/CaltechTHESIS:06042015-140901217
2014
Ariosa, Aileen Renia
(2014)
Mechanisms of Substrate Selection by the Signal Recognition Particle.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/AEDK-0925.
https://resolver.caltech.edu/CaltechTHESIS:05302014-103528106
Beardslee, Joseph Allen
(2014)
Magnetic Alignment of High-Aspect Ratio Microwires into Vertical Arrays.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/KNHK-AK52.
https://resolver.caltech.edu/CaltechTHESIS:05292014-124316181
Boney, Evans T. D.
(2014)
Vibrational Pooling and Constrained Equilibration on Surfaces.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/JM2J-XX84.
https://resolver.caltech.edu/CaltechTHESIS:09302013-141151012
Fu, Ross
(2014)
Iridium and Rhodium Analogues of the Shilov Cycle Catalyst; and The Investigation and Applications of the Reduction-Coupled Oxo Activation (ROA) Mechanistic Motif towards Alkane Upgrading.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/WY3F-DZ94.
https://resolver.caltech.edu/CaltechTHESIS:05212014-155104252
Goodpaster, Jason Daniel
(2014)
Density Functional Theory Embedding for Correlated Wavefunctions.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/RX3S-GH65.
https://resolver.caltech.edu/CaltechTHESIS:05302014-220000101
Hamdouche, Samy
(2014)
Engineered Antibody and Monobody Domains with T Cell Receptor-Like Selectivity for Tumor Associated Peptide-MHC Antigens.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/Z9WH2N02.
https://resolver.caltech.edu/CaltechTHESIS:06062014-175608943
Liu, Wei-Guang
(2014)
First-Principle Studies of the Initiation Mechanism of Energetic Materials.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/Z9445JGM.
https://resolver.caltech.edu/CaltechTHESIS:05232014-150103448
Menzeleev, Artur R.
(2014)
Direct Simulation of Quantum Dynamics in Complex Systems.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/PZ32-ZN60.
https://resolver.caltech.edu/CaltechTHESIS:05302014-112920946
Sosa Padilla Araujo, Bernardo
(2014)
Computational Enzyme Design.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/Z9KP805N.
https://resolver.caltech.edu/CaltechTHESIS:05052014-122744794
Trudeau, Devin Lee
(2014)
Engineering Enzyme Systems by Recombination.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/F8T8-3S80.
https://resolver.caltech.edu/CaltechTHESIS:01202014-144143175
Wolfe, Brian Robert
(2014)
Design and Analysis of Nucleic Acid Reaction Pathways.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/G4XZ-ZF47.
https://resolver.caltech.edu/CaltechTHESIS:03272014-193400848
2013
Bhawe, Yashodhan
(2013)
I: Solid Materials for Low Temperature Thermochemical Water Splitting. II: Structure-Property Relationships on the Zeolite Catalyzed Conversion of Methanol to Light Olefins.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/05FG-JG39.
https://resolver.caltech.edu/CaltechTHESIS:11282012-141927745
Boekelheide, Nicholas
(2013)
Quantum Simulation of Enzyme Catalysis.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/A27J-Q614.
https://resolver.caltech.edu/CaltechTHESIS:06102013-024419372
Ford, Nicole Danielle Bouley
(2013)
Capturing Protein Dynamics with Time-Resolved Luminescence Spectroscopy.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/N8B5-4644.
https://resolver.caltech.edu/CaltechTHESIS:05302013-155904165
Kelley, Matthew James
(2013)
Terahertz Time Domain Spectroscopy of Amino Acids and Sugars.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/FQ9S-JF63.
https://resolver.caltech.edu/CaltechTHESIS:04232013-183107863
McKone, James Robert
(2013)
Earth-Abundant Materials for Solar Hydrogen Generation.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/NDDJ-P611.
https://resolver.caltech.edu/CaltechTHESIS:06052013-140402659
Zhang, Bin
(2013)
Sec-facilitated Protein Translocation and Membrane Integration.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/6WWV-V190.
https://resolver.caltech.edu/CaltechTHESIS:10172012-174905364
2012
Theofanis, Patrick Lauren
(2012)
The Quantum Electron Dynamics of Materials Subjected to Extreme Environments.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/BJ5N-QV45.
https://resolver.caltech.edu/CaltechTHESIS:04262012-115237724
Kimball, Gregory Michael
(2012)
Zn₃P₂ and Cu₂O Substrates for Solar Energy Conversion.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/Q4F1-H538.
https://resolver.caltech.edu/CaltechTHESIS:10302011-182613259
Lin, Milo Miaoyu
(2012)
Protein Folding and Macromolecular Dynamics: Fundamental Limits of Length and Time Scales.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/CSW5-WY69.
https://resolver.caltech.edu/CaltechTHESIS:05282012-103610958
Long, David Alexander
(2012)
Frequency-Stabilized Cavity Ring-Down Spectroscopy of O₂ and CO₂ to Support Atmospheric Remote Sensing.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/CTFH-GZ09.
https://resolver.caltech.edu/CaltechTHESIS:06282011-172416252
Olmon, Eric Daniel
(2012)
Investigating DNA-Mediated Charge Transport by Time-Resolved Spectroscopy.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/6GDE-2707.
https://resolver.caltech.edu/CaltechTHESIS:10282011-143721555
2011
Dempsey, Jillian Lee
(2011)
Hydrogen Evolution Catalyzed by Cobaloximes.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/XK4M-DZ27.
https://resolver.caltech.edu/CaltechTHESIS:01252011-134049886
2010
Anderson, Amos Gerald
(2010)
Quantum Monte Carlo: Faster, More Reliable, and More Accurate.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/KVTV-N754.
https://resolver.caltech.edu/CaltechETD:etd-08122009-151332
Pascal, Tod Augustin
(2010)
New Approaches to Accurate Predictions of Free Energies: From Proteins to Organic Nanostructures.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/P0JH-QM60.
https://resolver.caltech.edu/CaltechTHESIS:10262009-204842274
Witman, Jennifer Elisabeth
(2010)
The T-Shaped Anisotropic Molecule Model: A Unique Perspective on the Glass Transition and Gelation in Low Valence, Directional, Network Forming Liquids.
Dissertation (Ph.D.), California Institute of Technology.
doi:10.7907/0XET-0H46.
https://resolver.caltech.edu/CaltechTHESIS:04122010-145555532
This list was generated on Thu Nov 21 11:00:51 2024 UTC.