Re: [gmx-users] totally misunderstood question about genbox

2007-03-13 Thread David van der Spoel
WILLIAM R WELCH wrote: Mark I'm sorry--that is not what I was saying at all--I did not have ANY waters originally defined in my .top file. I used editconf to make a cubic box that was 6 x 6 x 6 , then used genbox and in that step specified which topology file in which to insert the waters--a .top

[gmx-users] totally misunderstood question about genbox

2007-03-13 Thread WILLIAM R WELCH
Mark I'm sorry--that is not what I was saying at all--I did not have ANY waters originally defined in my .top file. I used editconf to make a cubic box that was 6 x 6 x 6 , then used genbox and in that step specified which topology file in which to insert the waters--a .top file with no water.