On Thu, May 27, 2010 at 5:40 PM, Robert Hanson wrote:
> Of course, the caveat is that the Universal Force Field is pretty simple and
> not at all accurate in terms of real energy, but still, it's awfully fun to
> see caffeine bounce off an enzyme!
For educational purposes this is brilliant!
Bob+
Well, what do you know? Eric Martz is going to go nuts...
Jmol now does docking with automatic minimization.
This is simply:
set picking dragMinimizeMolecule
Then, whenever you let go of a dragged a molecule, it minimizes
automatically. Holding SHIFT done does a molecular rotation.
In the ap
