Is there a program that does ? I was under the impression that they
were all equally good/bad at this, because any solution that agrees with
the PTS has quite a high score and any solution that doesn't has a low
score, irrespective of the correctness of the placement of the molecules.
In one case that ritually defeats me with quite strong pseudo-centering,
this seems to be true for heavy atom searches also.
Phil Jeffrey
Princeton
On 2/9/11 5:08 PM, Jon Schuermann wrote:
I would NOT use Phaser for MR with PTS present. It doesn't handle it
correctly yet, since the likelihood targets don't account for PTS.
Others may be able to explain it better.
