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Estrin, Dario Ariel
125
Journal of Chemical Theory and Computation
4
"QM-MM investigation of the reaction of peroxynitrite with carbon dioxide in water" (2007) González Lebrero, M.C.; Estrin, D.A. Journal of Chemical Theory and Computation. 3(4):1405-1411
"Structural and energetic study of cisplatin and derivatives: Comparison of the performance of density funtional theory implementations" (2008) Dans, P.D.; Crespo, A.; Estrin, D.A.; Coitiño, E.L. Journal of Chemical Theory and Computation. 4(5):740-750
"Coarse-grained simulations of heme proteins: Validation and study of large conformational transitions" (2016) Ramírez, C.L.;Petruk, A.;Bringas, M. (...)Capece, L. Journal of Chemical Theory and Computation. 12(7):3390-3397
"Role of core electrons in quantum dynamics using TDDFT" (2017) Foglia, N.O.;Morzan, U.N.;Estrin, D.A. (...)Lebrero, M.C.G. Journal of Chemical Theory and Computation. 13(1):77-85