Address

Contact Information

Mauro Lapelosa

Postdoctoral Researcher

2011-2013
“Studies in Transition-Path Theory”

Publications:

T. Yu, M. Lapelosa, E. Vanden-Eijnden, and C. F. Abrams, “Full kinetics of CO entry, internal diffusion, and exit in myoglobin from transition-path theory simulations,” Journal of the American Chemical Society, vol. 137, iss. 8, p. 3041–3050, 2015. [Bibtex] [doi]
@article{Yu_2015,
doi = {10.1021/ja512484q},
url = {https://doi.org/10.1021%2Fja512484q},
year = 2015,
month = {feb},
publisher = {American Chemical Society ({ACS})},
volume = {137},
number = {8},
pages = {3041--3050},
author = {Tang-Qing Yu and Mauro Lapelosa and Eric Vanden-Eijnden and Cameron F. Abrams},
title = {Full Kinetics of {CO} Entry, Internal Diffusion, and Exit in Myoglobin from Transition-Path Theory Simulations},
journal = {{Journal of the American Chemical Society}}
}

M. Lapelosa and C. F. Abrams, “Transition-path theory calculations on non-uniform meshes in two and three dimensions using finite elements,” Computer Physics Communications, vol. 184, iss. 10, p. 2310–2315, 2013. [Bibtex] [doi]
@article{Lapelosa_2013,
doi = {10.1016/j.cpc.2013.05.017},
url = {https://doi.org/10.1016%2Fj.cpc.2013.05.017},
year = 2013,
month = {oct},
publisher = {Elsevier {BV}},
volume = {184},
number = {10},
pages = {2310--2315},
author = {Mauro Lapelosa and Cameron F. Abrams},
title = {Transition-path theory calculations on non-uniform meshes in two and three dimensions using finite elements},
journal = {{Computer Physics Communications}}
}

M. Lapelosa and C. F. Abrams, “A computational study of water and CO migration sites and channels inside myoglobin,” Journal of Chemical Theory and Computation, vol. 9, iss. 2, p. 1265–1271, 2013. [Bibtex] [doi]
@article{Lapelosa_2013b,
doi = {10.1021/ct300862j},
url = {https://doi.org/10.1021%2Fct300862j},
year = 2013,
month = {jan},
publisher = {American Chemical Society ({ACS})},
volume = {9},
number = {2},
pages = {1265--1271},
author = {Mauro Lapelosa and Cameron F. Abrams},
title = {A Computational Study of Water and {CO} Migration Sites and Channels Inside Myoglobin},
journal = {{Journal of Chemical Theory and Computation}}
}