Thank you On Thu, Apr 28, 2011 at 6:26 PM, Ran Friedman <ran.fried...@lnu.se> wrote:
> Hi, > > That's unlikely, but maybe the following publications can help you to build > the surface: > > > @Article{Iori2008, > author = "Iori, F and Corni, S", > title = {Including image charge effects in the molecular dynamics > simulations of molecules on metal surfaces}, > journal = "J Comput Chem", > year = "2008", > volume = "29", > pages = "1656-1666" > } > > @Article{Iori2009, > author = "Iori, F and Di Felice, R and Molinari, E and Corni, S", > title = {{G}ol{P}: {A}n atomistic force-field to describe the interaction > of proteins with {A}u(111) surfaces in water}, > journal = "J Comput Chem", > year = "2009", > volume = "30", > pages = "1465-1476" > } > > @article{Kalcher2009, > Author = {Kalcher, I. and Horinek, D. and Netz, R. R. and Dzubiella, J.}, > Title = {{Ion specific correlations in bulk and at biointerfaces}}, > Journal = {JOURNAL OF PHYSICS-CONDENSED MATTER}, > Year = {{2009}}, > Volume = {{21}}, > Article-Number = {{424108}} > } > > ------------------------------------------------ > Ran Friedman > BitrÀdande Lektor (Assistant Professor) > > Linnaeus University > School of Natural Sciences > 391 82 Kalmar, Sweden > > NorrgÄrd, room 328d > +46 480 446 290 Telephone > +46 76 207 8763 Mobile > ran.fried...@lnu.se > http://lnu.se/ccbg > ------------------------------------------------ > > Hello, does anybody have an idea if there are availbale PDB files which > represent metal surfaces for transition state metals, to be used for MD? > > BW > > S > -- > gmx-users mailing list gmx-users@gromacs.org > http://lists.gromacs.org/mailman/listinfo/gmx-users > Please search the archive at > http://www.gromacs.org/Support/Mailing_Lists/Search before posting! > Please don't post (un)subscribe requests to the list. Use the > www interface or send it to gmx-users-requ...@gromacs.org. > Can't post? Read http://www.gromacs.org/Support/Mailing_Lists >
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