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Title: Quantum Mechanics/Molecular Mechanics Free Energy Maps and Nonadiabatic Simulations for a Photochemical Reaction in DNA: Cyclobutane Thymine Dimer

Abstract

Not provided.

Authors:
 [1];  [2];  [3];  [4];  [5];  [2]
  1. Departamento de Física Teórica de la Materia Condensada and Condensed Matter Physics Center (IFIMAC), Universidad Autónoma de Madrid, ES-28049 Madrid, Spain; Molecular Modelling Group, Center of Molecular Biology Severo Ochoa (CSIC-UAM), ES-28049 Madrid, Spain
  2. Departamento de Física Teórica de la Materia Condensada and Condensed Matter Physics Center (IFIMAC), Universidad Autónoma de Madrid, ES-28049 Madrid, Spain
  3. Departamento de Física Teórica de la Materia Condensada and Condensed Matter Physics Center (IFIMAC), Universidad Autónoma de Madrid, ES-28049 Madrid, Spain; Molecular Modelling Group, Center of Molecular Biology Severo Ochoa (CSIC-UAM), ES-28049 Madrid, Spain; Departamento de Biotecnología, Universidad Francisco de Vitoria, ctra. Pozuelo-Majadahonda, km 1,800, 28223 Pozuelo de Alarcón, Madrid, Spain
  4. Department of Physics, West Virginia University, Morgantown, West Virginia 26506-6315, United States
  5. Molecular Modelling Group, Center of Molecular Biology Severo Ochoa (CSIC-UAM), ES-28049 Madrid, Spain
Publication Date:
Research Org.:
West Virginia Univ., Morgantown, WV (United States)
Sponsoring Org.:
USDOE Office of Science (SC)
OSTI Identifier:
1534702
DOE Contract Number:  
SC0004737
Resource Type:
Journal Article
Journal Name:
Journal of Physical Chemistry Letters
Additional Journal Information:
Journal Volume: 7; Journal Issue: 21; Journal ID: ISSN 1948-7185
Publisher:
American Chemical Society
Country of Publication:
United States
Language:
English
Subject:
Chemistry; Science & Technology - Other Topics; Materials Science; Physics

Citation Formats

Mendieta-Moreno, Jesús I., Trabada, Daniel G., Mendieta, Jesús, Lewis, James P., Gómez-Puertas, Paulino, and Ortega, José. Quantum Mechanics/Molecular Mechanics Free Energy Maps and Nonadiabatic Simulations for a Photochemical Reaction in DNA: Cyclobutane Thymine Dimer. United States: N. p., 2016. Web. doi:10.1021/acs.jpclett.6b02168.
Mendieta-Moreno, Jesús I., Trabada, Daniel G., Mendieta, Jesús, Lewis, James P., Gómez-Puertas, Paulino, & Ortega, José. Quantum Mechanics/Molecular Mechanics Free Energy Maps and Nonadiabatic Simulations for a Photochemical Reaction in DNA: Cyclobutane Thymine Dimer. United States. doi:10.1021/acs.jpclett.6b02168.
Mendieta-Moreno, Jesús I., Trabada, Daniel G., Mendieta, Jesús, Lewis, James P., Gómez-Puertas, Paulino, and Ortega, José. Mon . "Quantum Mechanics/Molecular Mechanics Free Energy Maps and Nonadiabatic Simulations for a Photochemical Reaction in DNA: Cyclobutane Thymine Dimer". United States. doi:10.1021/acs.jpclett.6b02168.
@article{osti_1534702,
title = {Quantum Mechanics/Molecular Mechanics Free Energy Maps and Nonadiabatic Simulations for a Photochemical Reaction in DNA: Cyclobutane Thymine Dimer},
author = {Mendieta-Moreno, Jesús I. and Trabada, Daniel G. and Mendieta, Jesús and Lewis, James P. and Gómez-Puertas, Paulino and Ortega, José},
abstractNote = {Not provided.},
doi = {10.1021/acs.jpclett.6b02168},
journal = {Journal of Physical Chemistry Letters},
issn = {1948-7185},
number = 21,
volume = 7,
place = {United States},
year = {2016},
month = {10}
}