Anna Pavlova

According to our database, Anna Pavlova authored at least 7 papers between 2004 and 2025.

Collaborative distances:

• Dijkstra number of four.
• Erdős number of four.

2025

Machine Learning of Molecular Dynamics Simulations Provides Insights into the Modulation of Viral Capsid Assembly.

Anna Pavlova, Zixing Fan, Diane L. Lynch, James C. Gumbart

J. Chem. Inf. Model., 2025

2024

Automated Identification of Existing and Potential Urban Central Places Based on Open Data and Public Interest.

Anna Pavlova, Aleksandr Katynsus, Maksim Natykin, Sergey A. Mityagin

Proceedings of the Computational Science and Its Applications - ICCSA 2024, 2024

2020

Supercomputer-Based Ensemble Docking Drug Discovery Pipeline with Application to Covid-19.

Atanu Acharya, Rupesh Agarwal, Matthew B. Baker, Jérôme Baudry, Debsindhu Bhowmik, Swen Böhm, Kendall G. Byler, Sam Yen-Chi Chen, Leighton Coates, Connor J. Cooper, Omar Demerdash, Isabella Daidone, John D. Eblen, Sally R. Ellingson, Stefano Forli, Jens Glaser, James C. Gumbart, John Gunnels, Oscar R. Hernandez, Stephan Irle, Daniel W. Kneller, Andrey Kovalevsky, Jeffrey M. Larkin, Travis J. Lawrence, Scott LeGrand, Shih-Hsien Liu, Julie C. Mitchell, Gilchan Park, Jerry M. Parks, Anna Pavlova, Loukas Petridis, Duncan Poole, Line Pouchard, Arvind Ramanathan, David M. Rogers, Diogo Santos-Martins, Aaron Scheinberg, Ada Sedova, Yue Shen, Jeremy C. Smith, Micholas Dean Smith, Carlos Soto, Aristides Tsaris, Mathialakan Thavappiragasam, Andreas F. Tillack, Josh Vincent Vermaas, Van Quan Vuong, Junqi Yin, Shinjae Yoo, Mai Zahran, Laura Zanetti Polzi

J. Chem. Inf. Model., 2020

2016

Simulation-Based Approaches for Determining Membrane Permeability of Small Compounds.

Christopher T. Lee, Jeffrey Comer, Conner Herndon, Nelson Leung, Anna Pavlova, Robert V. Swift, Chris Tung, Christopher N. Rowley, Rommie E. Amaro, Christophe Chipot, Yi Wang, James C. Gumbart

J. Chem. Inf. Model., 2016

2015

Parametrization of macrolide antibiotics using the force field toolkit.

Anna Pavlova, James C. Gumbart

J. Comput. Chem., 2015

2008

Multiplicity in general financial equilibrium with portfolio constraints.

Suleyman Basak, David Cass, Juan Manuel Licari, Anna Pavlova

J. Econ. Theory, 2008

2004

On trees and logs.

David Cass, Anna Pavlova

J. Econ. Theory, 2004