[gmx-users] Re: Re: hydrophobic and hydrophilic in implicit solvent

2012-03-08 Thread bo.shuang
Hi, Thank you for your answer. May I ask where I can find the right parameter in gbsa.itp for ions? These should be very basic things in simulation, but I cannot find their parameters anywhere. How do you guys use implicit solvent if you want to have ions inside? Thank you! Bo bo.shuang wrote:

Re: [gmx-users] Re: Re: hydrophobic and hydrophilic in implicit solvent

2012-03-08 Thread Mark Abraham
On 9/03/2012 7:19 AM, bo.shuang wrote: Hi, Thank you for your answer. May I ask where I can find the right parameter in gbsa.itp for ions? These should be very basic things in simulation, but I cannot find their parameters anywhere. How do you guys use implicit solvent if you want to have