molrep can deal with some of the PST cases.
Garib
On 9 Feb 2011, at 22:27, Phil Jeffrey wrote:
> 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.
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