X-pol potential: An electronic structure-based force field for molecular dynamics simulation of a solvated protein in water

Journal of Chemical Theory and Computation

Volumn 5, Issue 3, 2009, Pages 459-467

  Xie, Wangshen ^a,c   Orozco, Modesto ^b,c   Truhlar, Donald G ^a,c   Gao, Jiali ^a,b,c  

^a University of Minnesota   (United States)

^b BARCELONA SUPERCOMPUTING CENTER   (Spain)

^c ERA Biotech   (Spain)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 65249108161     PISSN: 15499618     EISSN: None     Source Type: Journal    
DOI: 10.1021/ct800239q     Document Type: Article

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