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Ramon Carbó-Dorca
Least squares estimation of unknown molecular properties and quantum QSPR fundamental equation
J. Math. Chem., 2015, 53, 1651-1656
DOI: 10.1007/s10910-015-0521-7

Ramon Carbó-Dorca
An isometric representation problem in quantum multimolecular polyhedra and similarity
J. Math. Chem., 2015, 53, 1750-1758
DOI: 10.1007/s10910-015-0516-4

Ramon Carbó-Dorca
An isometric representation problem in quantum multimolecular polyhedra and similarity: (2) synisometry
J. Math. Chem., 2015, 53, 1876-1884
DOI: 10.1007/s10910-015-0525-3

Ramon Carbó-Dorca
Coulomb repulsion, point-like nuclear charges, Dirac paradox, soft nuclear charge density and hypermultiplet nuclear repulsion
J. Math. Chem., 2015, 53, 590-603
DOI: 10.1007/s10910-014-0436-8
Keywords: Molecular similarity

ChristopherJ. Lech, AnhTuân Phan, Maria-Elisabeth Michel-Beyerle, Alexander A. Voityuk
Influence of Base Stacking Geometry on the Nature of Excited States in G-Quadruplexes: A Time-Dependent DFT Study
J. Phys. Chem. B, 2015, 119, 3697-3705
DOI: 10.1021/jp512767j

Alexander A. Voityuk
Interaction of Dark Excited States. Comparison of Computational Approaches
J. Phys. Chem. B, 2015, 119, 7417-7421
DOI: 10.1021/jp511035p

Marina Corbella, Alexander A. Voityuk, Carles Curutchet
Single Amino Acid Mutation Controls Hole Transfer Dynamics in DNA-MethyltransferaseHha I Complexes
J. Phys. Chem. Lett.
, 2015, 6
, 3749-3753
DOI: 10.1021/acs.jpclett.5b01683

Yuqi Zhang, Ryan M. Young, Arun K. Thazhathveetil, Arunoday P.N. Singh, Chaoren Liu, Yuri A. Berlin, Ferdinand C. Grozema, Frederick D. Lewis, Mark A. Ratner, Nicolas Renaud, Khatcharin Siriwong, Alexander A. Voityuk, Michael R. Wasielewski, David N. Beratan
Conformationally Gated Charge Transfer in DNA Three-Way Junctions
J. Phys. Chem. Lett., 2015, 6, 2434-2438
DOI: 10.1021/acs.jpclett.5b00863

Simone Manzini, César A. Urbina-Blanco, David J. Nelson, Albert Poater, Tomas Lebl, Sébastien Meiries, Alexandra M. Z. Slawin, Laura Falivene, Luigi Cavallo, Steven P. Nolan
Evaluation of an olefin metathesis pre-catalyst with a bulky and electron-rich N-heterocyclic carbene
Journal of Organometallic Chemistry, 2015, 780, 43-48
DOI: 10.1016/j.jorganchem.2014.12.040

Maja Gruden, Stepan Stepanovic, Marcel Swart
Spin state relaxation of iron complexes: The case for OPBE and S12g
JSCS, 2015, 80, 1399-1410
DOI: 10.2298/JSC150611068G
Keywords: Spin states