On 3/3/15 10:37 PM, Arijit Ghosh wrote:
>> Summary of successfully produced models:
Filename molpdf DOPE score GA341 score
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molpdf and DOPE are both "energy" scores, so don't tell you if your model is "good" - you can only really use them to rank models. A GA341 score of 1.0 does suggest a good model, but a better score to use these days is normalized DOPE.
Ben Webb, Modeller Caretaker
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