Ivani, IvanDans, Pablo D.Noy Freixa, AgnèsPérez, AlbertoFaustino Pló, IgnacioHospital Gasch, AdamWalther, JürgenAndrio, PauGoñi Macià, Josep RamonBalaceanu, AlexandraPortella, GuillemBattistini, FedericaGelpí Buchaca, Josep LluísGonzález, CarlosVendruscolo, MicheleLaughton, Charles A.Harris, Sarah A.Case, David A.Orozco López, Modesto2018-03-232018-03-232016-011548-7091https://hdl.handle.net/2445/121068We present parmbsc1, a force field for DNA atomistic simulation, which has been parameterized from high-level quantum mechanical data and tested for nearly 100 systems (representing a total simulation time of ∼140 μs) covering most of DNA structural space. Parmbsc1 provides high-quality results in diverse systems. Parameters and trajectories are available at http://mmb.irbbarcelona.org/ParmBSC1/.4 p.application/pdfeng(c) Ivani, Ivan et al., 2016BiofísicaADNBiophysicsDNAinfo:eu-repo/semantics/article6552152018-03-23info:eu-repo/semantics/openAccess26569599