Thereza A. Soares

University of Oslo — Norway

Biochemistry, Genetics and Molecular Biology · Life Sciences

30h-index3.4kcitations135works3.22yr avg
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Research Topics

Lipid Membrane Structure and Behavior(32), Protein Structure and Dynamics(13), Antimicrobial Peptides and Activities(13), Surfactants and Colloidal Systems(12), Spectroscopy and Quantum Chemical Studies(12)

Publications135 total

Beyond Summary: Reviews That Shape the Field of Computational Molecular Sciences
Journal of Chemical Information and Modeling·2026
The many dimeric faces of Lys49 PLA <sub>2</sub> ‐like proteins: Conformational plasticity and membrane binding drive functional dimer states
Protein Science·2026Open Access
Reflections on the 65 Years of the <i>Journal of Chemical Information and Modeling</i> : Scientific Impact, Community, and the Evolution of Computational Molecular Science
Journal of Chemical Information and Modeling·2025
The Effect of Ceramide Ratio on the Membrane Curvature of Mimetic Models of Matrix Vesicles
ACS Physical Chemistry Au·2025· 1 citedOpen Access
Coarse-Grained Parameters for Simulations of Methyl-Methacrylate-Based Polymer Brushes That Reproduce Experimental Swelling Coefficients
Macromolecules·2025· 2 citedOpen Access
Computational Chemistry in the Global South: A Latin American Perspective
Journal of Chemical Theory and Computation·2025· 2 citedOpen Access
Computational Chemistry in the Global South: A Latin American Perspective
Journal of Chemical Information and Modeling·2025· 2 citedOpen Access
EDITORIAL: Chemical Compound Space Exploration by Multiscale High-Throughput Screening and Machine Learning
Journal of Chemical Information and Modeling·2024· 3 citedOpen Access
Editorial: Machine Learning in Materials Science
Journal of Chemical Information and Modeling·2024· 13 citedOpen Access
Enhancing Coarse-Grained Models through Machine Learning
Journal of Chemical Information and Modeling·2024Open Access
Interfacial structurization between triolein and water from pH and buffer ions
Journal of Colloid and Interface Science·2024· 13 citedOpen Access
The Impact of Interdisciplinary, Gender and Geographic Distributions on the Citation Patterns of the Journal of Chemical Information and Modeling
Journal of Chemical Information and Modeling·2024· 5 citedOpen Access
Ph-Induced Morphological Changes of Membranes Composed of Bis(Monoacylglycero)Phosphate, a Typical Lysosomal Lipid
SSRN Electronic Journal·2024· 1 citedOpen Access
Editorial: Editing DNA and RNA through Computations
Journal of Chemical Information and Modeling·2023· 1 cited
Dataset for article: Antimicrobial peptide induced colloidal transformations in bacteria-mimetic vesicles: Combining in silico tools and experimental methods
Zenodo (CERN European Organization for Nuclear Research)·2023Open Access
Dataset for article: Antimicrobial peptide induced colloidal transformations in bacteria-mimetic vesicles: Combining in silico tools and experimental methods
Zenodo (CERN European Organization for Nuclear Research)·2023Open Access
Accelerating Lipid Flip-Flop at Low Concentrations: A General Mechanism for Membrane Binding Peptides
The Journal of Physical Chemistry Letters·2023· 10 citedOpen Access
Exploring the Molecular Dynamics of a Lipid-A Vesicle at the Atom Level: Morphology and Permeation Mechanism
The Journal of Physical Chemistry B·2023· 5 citedOpen Access
Guidelines for Reporting Molecular Dynamics Simulations in JCIM Publications
Journal of Chemical Information and Modeling·2023· 23 cited
Inhibition of 3-Hydroxykynurenine Transaminase from <i>Aedes aegypti</i> and <i>Anopheles gambiae</i>: A Mosquito-Specific Target to Combat the Transmission of Arboviruses
ACS Bio & Med Chem Au·2023· 7 citedOpen Access
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Frequent Co-authors

Roberto D. Lins(9), Gabriel C. A. da Hora(6), Denys E. S. Santos(6), Tjerk P. Straatsma(5), Chris Oostenbrink(4), Wilfred F. van Gunsteren(4), Frederico J. S. Pontes(4), James M. Briggs(4), Severino Alves(3), Kenneth M. Merz(3), Júlio C. S. Da Silva(3), Heibbe C. B. de Oliveira(3), Brenno A. D. Neto(3), Michele Cascella(3), Madeleine Ramstedt(3), Roberta P. Dias(3), Iane B. Vasconcelos(2), Marcelo O. Rodrigues(2), Yuxian He(2), Xavier Daura(2)