Hi

I had solvated and minimized protein structure for200 steps of steepest descent and  5000 steps of conjugate gradientabilised  Further I had used  heating cooling for 10000 steps. But Iam unable run equilibration dynamics.

I had selected the final conformation and copied pasted it in another window and is trying to run equilibration protocol. but i am getting charm log failed as error. wheras molecule has been typed with Charm.

please help me how to select and use the conformation file after heating cooling

divya