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Phys."},{"key":"ref27\/cit27","doi-asserted-by":"crossref","first-page":"331","DOI":"10.1007\/978-94-015-7658-1_21","volume-title":"Intermolecular Forces","author":"Berendsen H. J. C.","year":"1981"},{"issue":"1","key":"ref28\/cit28","doi-asserted-by":"crossref","first-page":"193","DOI":"10.1080\/00268978700100141","volume":"60","author":"Teleman O.","year":"1987","journal-title":"Mol. Phys."},{"key":"ref29\/cit29","doi-asserted-by":"crossref","first-page":"054511","DOI":"10.1063\/1.2234774","volume":"125","author":"Piquemal J.-P.","year":"2006","journal-title":"J. Chem. Phys."},{"key":"ref30\/cit30","doi-asserted-by":"crossref","first-page":"2068","DOI":"10.1021\/ct700172b","volume":"3","author":"Whitfield T. W.","year":"2007","journal-title":"J. Chem. Theory Comput."},{"issue":"16","key":"ref31\/cit31","doi-asserted-by":"crossref","first-page":"7011","DOI":"10.1063\/1.471990","volume":"105","author":"Ishii R.","year":"1996","journal-title":"J. Chem. 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