Douglas J Tobias

Publication Activity (10 Years)

Years Active: 2017-2024
Publications (10 Years): 35

Top Topics

Aqueous Solution

Particulate Matter

Molecular Dynamics

Top Venues

The journal of physical chemistry. B

Journal of computational chemistry

Physical chemistry chemical physics : PCCP

Environmental science & technology

This page only lists publications with an associated author ORCID identifier.

Publications

Yuanming Song, Serxho Selmani, J Alfredo Freites, Zhibin Guan, Douglas J Tobias
Multiscale Molecular Dynamics Simulations of an Active Self-Assembling Material. The journal of physical chemistry. B (2024)
Yuanming Song, Serxho Selmani, J Alfredo Freites, Zhibin Guan, Douglas J Tobias
Multiscale Molecular Dynamics Simulations of an Active Self-Assembling Material. The journal of physical chemistry. B 128 (5) (2024)
J Alfredo Freites, Douglas J Tobias
Molecular Dynamics Simulations of the Eye Lens Water Channel Aquaporin 0 from Fish. The journal of physical chemistry. B 128 (31) (2024)
J Alfredo Freites, Douglas J Tobias
Molecular Dynamics Simulations of the Eye Lens Water Channel Aquaporin 0 from Fish. The journal of physical chemistry. B 128 (31) (2024)
J Alfredo Freites, Douglas J Tobias
Molecular Dynamics Simulations of the Eye Lens Water Channel Aquaporin 0 from Fish. The journal of physical chemistry. B 128 (31) (2024)
J Alfredo Freites, Douglas J Tobias
Molecular Dynamics Simulations of the Eye Lens Water Channel Aquaporin 0 from Fish. The journal of physical chemistry. B 128 (31) (2024)
J Alfredo Freites, Douglas J Tobias
Molecular Dynamics Simulations of the Eye Lens Water Channel Aquaporin 0 from Fish. The journal of physical chemistry. B (2024)
Elizabeth M Diessner, J Alfredo Freites, Douglas J Tobias, Carter T Butts
Network Hamiltonian Models for Unstructured Protein Aggregates, with Application to γD-Crystallin. The journal of physical chemistry. B 127 (3) (2023)
Elianna S Frank, Hanyu Fan, Vicki H Grassian, Douglas J Tobias
Adsorption of 6-MHO on two indoor relevant surface materials: SiO 2 and TiO 2 . Physical chemistry chemical physics : PCCP (2023)
Elianna S Frank, Hanyu Fan, Vicki H Grassian, Douglas J Tobias
Adsorption of 6-MHO on two indoor relevant surface materials: SiO 2 and TiO 2 . Physical chemistry chemical physics : PCCP 25 (5) (2023)
Elizabeth M Diessner, J Alfredo Freites, Douglas J Tobias, Carter T Butts
Network Hamiltonian Models for Unstructured Protein Aggregates, with Application to γD-Crystallin. The journal of physical chemistry. B 127 (3) (2023)
J Alfredo Freites, Mohab N Louis, Douglas J Tobias
Insights into the solubility of γ $$ \gamma $$ D-crystallin from multiscale atomistic simulations. Journal of computational chemistry (2023)
J Alfredo Freites, Mohab N Louis, Douglas J Tobias
Insights into the solubility of γ $$ \gamma $$ D-crystallin from multiscale atomistic simulations. Journal of computational chemistry (2023)
J Alfredo Freites, Mohab N Louis, Douglas J Tobias
Insights into the solubility of γ $$ \gamma $$ D-crystallin from multiscale atomistic simulations. Journal of computational chemistry (2023)
Elizabeth M Diessner, J Alfredo Freites, Douglas J Tobias, Carter T Butts
Network Hamiltonian Models for Unstructured Protein Aggregates, with Application to γD-Crystallin. The journal of physical chemistry. B (2023)
J Alfredo Freites, Mohab N Louis, Douglas J Tobias
Insights into the solubility of γ $$ \gamma $$ D-crystallin from multiscale atomistic simulations. Journal of computational chemistry (2023)
Elianna S Frank, Hanyu Fan, Vicki H Grassian, Douglas J Tobias
Adsorption of 6-MHO on two indoor relevant surface materials: SiO 2 and TiO 2 . Physical chemistry chemical physics : PCCP 25 (5) (2023)
Elizabeth M Diessner, J Alfredo Freites, Douglas J Tobias, Carter T Butts
Network Hamiltonian Models for Unstructured Protein Aggregates, with Application to γD-Crystallin. The journal of physical chemistry. B 127 (3) (2023)
Hanyu Fan, Elianna S Frank, Douglas J Tobias, Vicki H Grassian
Interactions of limonene and carvone on titanium dioxide surfaces. Physical chemistry chemical physics : PCCP 24 (38) (2022)
Zilin Zhou, Pascale S J Lakey, Michael von Domaros, Natsuko Wise, Douglas J Tobias, Manabu Shiraiwa, Jonathan P D Abbatt
Multiphase Ozonolysis of Oleic Acid-Based Lipids: Quantitation of Major Products and Kinetic Multilayer Modeling. Environmental science & technology 56 (12) (2022)
Michael von Domaros, Yangdongling Liu, Jana L Butman, Eva Perlt, Franz M Geiger, Douglas J Tobias
Molecular Orientation at the Squalene/Air Interface from Sum Frequency Generation Spectroscopy and Atomistic Modeling. The journal of physical chemistry. B 125 (15) (2021)
Andrew D Geragotelis, J Alfredo Freites, Douglas J Tobias
Anomalous Diffusion of Peripheral Membrane Signaling Proteins from All-Atom Molecular Dynamics Simulations. The journal of physical chemistry. B 125 (35) (2021)
Liubin Huang, Elianna S Frank, Mona Shrestha, Saleh Riahi, Douglas J Tobias, Vicki H Grassian
Heterogeneous Interactions of Prevalent Indoor Oxygenated Organic Compounds on Hydroxylated SiO2 Surfaces. Environmental science & technology 55 (10) (2021)
Elianna S Frank, Hanyu Fan, Mona Shrestha, Saleh Riahi, Douglas J Tobias, Vicki H Grassian
Impact of Adsorbed Water on the Interaction of Limonene with Hydroxylated SiO2: Implications of π-Hydrogen Bonding for Surfaces in Humid Environments. The journal of physical chemistry. A 124 (50) (2020)
Michael von Domaros, Pascale S J Lakey, Manabu Shiraiwa, Douglas J Tobias
Multiscale Modeling of Human Skin Oil-Induced Indoor Air Chemistry: Combining Kinetic Models and Molecular Dynamics. The journal of physical chemistry. B 124 (18) (2020)
Yuan Fang, Pascale S J Lakey, Saleh Riahi, Andrew T McDonald, Mona Shrestha, Douglas J Tobias, Manabu Shiraiwa, Vicki H Grassian
A molecular picture of surface interactions of organic compounds on prevalent indoor surfaces: limonene adsorption on SiO2. Chemical science 10 (10) (2019)
Eric K Wong, Vera Prytkova, J Alfredo Freites, Carter T Butts, Douglas J Tobias
Molecular Mechanism of Aggregation of the Cataract-Related γD-Crystallin W42R Variant from Multiscale Atomistic Simulations. Biochemistry 58 (35) (2019)
Bibhab Bandhu Majumdar, Vera Prytkova, Eric K Wong, J Alfredo Freites, Douglas J Tobias, Matthias Heyden
Role of Conformational Flexibility in Monte Carlo Simulations of Many-Protein Systems. Journal of chemical theory and computation 15 (2) (2019)
James E Hall, J Alfredo Freites, Douglas J Tobias
Experimental and Simulation Studies of Aquaporin 0 Water Permeability and Regulation. Chemical reviews 119 (9) (2019)
Sara Capponi, Stephen H White, Douglas J Tobias, Matthias Heyden
Structural Relaxation Processes and Collective Dynamics of Water in Biomolecular Environments. The journal of physical chemistry. B 123 (2) (2019)
Yuan Fang, Saleh Riahi, Andrew T McDonald, Mona Shrestha, Douglas J Tobias, Vicki H Grassian
What Is the Driving Force behind the Adsorption of Hydrophobic Molecules on Hydrophilic Surfaces? The journal of physical chemistry letters 10 (3) (2019)
Mona L Wood, J Alfredo Freites, Francesco Tombola, Douglas J Tobias
Atomistic Modeling of Ion Conduction through the Voltage-Sensing Domain of the Shaker K+ Ion Channel. The journal of physical chemistry. B 121 (15) (2017)
Greg Starek, J Alfredo Freites, Simon Bernèche, Douglas J Tobias
Gating energetics of a voltage-dependent K+ channel pore domain. Journal of computational chemistry 38 (16) (2017)
Giorgia Olivieri, Krista M Parry, Raffaella D'Auria, Douglas J Tobias, Matthew A Brown
Specific Anion Effects on Na+ Adsorption at the Aqueous Solution-Air Interface: MD Simulations, SESSA Calculations, and Photoelectron Spectroscopy Experiments. The journal of physical chemistry. B 122 (2) (2017)
Lisa Götte, Krista M Parry, Wei Hua, Dominique Verreault, Heather C Allen, Douglas J Tobias
Solvent-Shared Ion Pairs at the Air-Solution Interface of Magnesium Chloride and Sulfate Solutions Revealed by Sum Frequency Spectroscopy and Molecular Dynamics Simulations. The journal of physical chemistry. A 121 (34) (2017)