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Ryan G. Mullen, Ph.D. - Publications

Affiliations: 
2014 Chemical Engineering University of California, Santa Barbara, Santa Barbara, CA, United States 
Area:
Physical Chemistry, Theory & Computation, Biochemistry & Biophysics, Biomedical Sciences, Biology-Inspired Chemistry & Physics, Structural Chemistry, Spectroscopy & Advanced Analysis
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12 high-probability publications. We are testing a new system for linking publications to authors. You can help! If you notice any inaccuracies, please sign in and mark papers as correct or incorrect matches. If you identify any major omissions or other inaccuracies in the publication list, please let us know.

Year Citation  Score
2018 Mullen RG, Corcelli SA, Maginn EJ. Reaction Ensemble Monte Carlo Simulations of CO2 Absorption in the Reactive Ionic Liquid Triethyl(octyl)phosphonium 2-Cyanopyrrolide. The Journal of Physical Chemistry Letters. PMID 30136851 DOI: 10.1021/Acs.Jpclett.8B02304  0.339
2018 Sheridan QR, Mullen RG, Lee TB, Maginn EJ, Schneider WF. Hybrid Computational Strategy for Predicting CO2 Solubilities in Reactive Ionic Liquids The Journal of Physical Chemistry C. 122: 14213-14221. DOI: 10.1021/Acs.Jpcc.8B02095  0.338
2017 Yoo B, Marin-Rimoldi E, Mullen RG, Jusufi A, Maginn EJ. A Discrete Fractional Component Monte Carlo Simulation Study of Dilute Nonionic Surfactants at the Air-Water Interface. Langmuir : the Acs Journal of Surfaces and Colloids. PMID 28845994 DOI: 10.1021/Acs.Langmuir.7B02058  0.372
2017 Mullen RG, Maginn EJ. Reaction ensemble Monte Carlo simulation of xylene isomerization in bulk phases and under confinement. Journal of Chemical Theory and Computation. PMID 28749674 DOI: 10.1021/Acs.Jctc.7B00498  0.35
2016 Fechner U, de Graaf C, Torda AE, Güssregen S, Evers A, Matter H, Hessler G, Richmond NJ, Schmidtke P, Segler MHS, Waller MP, Pleik S, Shea JE, Levine Z, Mullen R, et al. 11th German Conference on Chemoinformatics (GCC 2015) : Fulda, Germany. 8-10 November 2015. Journal of Cheminformatics. 8: 18. PMID 29270804 DOI: 10.1186/S13321-016-0119-5  0.368
2016 Levine ZA, Rapp MV, Wei W, Mullen RG, Wu C, Zerze GH, Mittal J, Waite JH, Israelachvili JN, Shea JE. Surface force measurements and simulations of mussel-derived peptide adhesives on wet organic surfaces. Proceedings of the National Academy of Sciences of the United States of America. PMID 27036002 DOI: 10.1073/Pnas.1603065113  0.489
2015 Mullen RG, Shea JE, Peters B. Easy Transition Path Sampling Methods: Flexible-Length Aimless Shooting and Permutation Shooting. Journal of Chemical Theory and Computation. 11: 2421-8. PMID 26575542 DOI: 10.1021/Acs.Jctc.5B00032  0.497
2015 Zerze GH, Mullen RG, Levine ZA, Shea JE, Mittal J. To What Extent Does Surface Hydrophobicity Dictate Peptide Folding and Stability near Surfaces? Langmuir : the Acs Journal of Surfaces and Colloids. 31: 12223-30. PMID 26484800 DOI: 10.1021/Acs.Langmuir.5B03814  0.49
2014 Mullen RG, Shea JE, Peters B. Transmission Coefficients, Committors, and Solvent Coordinates in Ion-Pair Dissociation. Journal of Chemical Theory and Computation. 10: 659-67. PMID 26580043 DOI: 10.1021/Ct4009798  0.534
2014 Mullen RG, Shea JE, Peters B. Communication: an existence test for dividing surfaces without recrossing. The Journal of Chemical Physics. 140: 041104. PMID 25669495 DOI: 10.1063/1.4862504  0.474
2013 Peters B, Bolhuis PG, Mullen RG, Shea JE. Reaction coordinates, one-dimensional Smoluchowski equations, and a test for dynamical self-consistency. The Journal of Chemical Physics. 138: 054106. PMID 23406097 DOI: 10.1063/1.4775807  0.506
2013 Peters B, Bolhuis PG, Mullen RG, Shea JE. Reaction coordinates, one-dimensional Smoluchowski equations, and a test for dynamical self-consistency Journal of Chemical Physics. 138. DOI: 10.1063/1.4775807  0.441
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