Barbara Logan Mooney

Computer Science · Physical Sciences

5h-index145citations6works0.02yr avg
OpenAlex↗Google Scholar↗

Accepting Students?

No reports yet. Know if this professor is taking students?

Research Topics

Computational Drug Discovery Methods(3), Molecular spectroscopy and chirality(3), Advanced Chemical Physics Studies(2), Various Chemistry Research Topics(2), Protein Structure and Dynamics(1)

Publications6 total

Elucidating the Properties of Surrogate Fuel Mixtures Using Molecular Dynamics
Energy & Fuels·2016· 22 cited
Recent developments and simulations utilizing bond-order potentials
Modelling and Simulation in Materials Science and Engineering·2015· 15 cited
Determining polyhedral arrangements of atoms using PageRank
Journal of Mathematical Chemistry·2012· 22 cited
Novel Analysis of Cation Solvation Using a Graph Theoretic Approach
The Journal of Physical Chemistry B·2012· 25 cited
<i>MoleculaRnetworks</i>: An integrated graph theoretic and data mining tool to explore solvent organization in molecular simulation
Journal of Computational Chemistry·2012· 61 cited
An Integrated Graph-Theoretic Approach to Understanding Solvation Using a Novel Data Mining Tool, moleculaRnetworks
UA Campus Repository (The University of Arizona)·2012

Frequent Co-authors

Aurora E. Clark(3), L. René Corrales(2), J. David Schall(2), Judith A. Harrison(2), M. Todd Knippenberg(2), Matthew Hudelson(1), Brian H. Morrow(1), Keith Van Nostrand(1), Dianne J. Luning Prak(1), Paul C. Trulove(1), Robert E. Morris(1), Marcel Fallet(1), Kathleen E. Ryan(1)