Re: Re : Re : [gmx-users] Adding Ions

2011-07-13 Thread Justin A. Lemkul
Objet :* Re: Re : [gmx-users] Adding Ions Justin A. Lemkul wrote: > > > errabah fatima ezzahra wrote: >> i added the NA using the genion >>* >> >> genion -s em.tpr -o waterbox_ions.gro -np 6 , and i added the NA to the topology file , subtracted

Re : Re : [gmx-users] Adding Ions

2011-07-13 Thread errabah fatima ezzahra
Objet : Re: Re : [gmx-users] Adding Ions Justin A. Lemkul wrote: > > > errabah fatima ezzahra wrote: >> i added the NA using the genion >>    * >> >>      genion -s em.tpr -o waterbox_ions.gro -np 6 , and i added the NA to >>the topology file ,

Re: Re : [gmx-users] Adding Ions

2011-07-13 Thread Justin A. Lemkul
Justin A. Lemkul wrote: errabah fatima ezzahra wrote: i added the NA using the genion * genion -s em.tpr -o waterbox_ions.gro -np 6 , and i added the NA to the topology file , subtracted the water number by 6. tail waterbox_ions.gro file have this 3567WW 3789 1.256

Re: Re : [gmx-users] Adding Ions

2011-07-13 Thread Justin A. Lemkul
errabah fatima ezzahra wrote: i added the NA using the genion * genion -s em.tpr -o waterbox_ions.gro -np 6 , and i added the NA to the topology file , subtracted the water number by 6. tail waterbox_ions.gro file have this 3567WW 3789 1.256 3.600 3.784 3568W