Bug with Calculations >> 3D Alignment

User ac9e79dc7d

29-10-2015 19:05:30

I have encountered a recent bug with the 3D Alignment tool; it used to be that I could keep the 3D conformation of one of the two molecules rigid by selecting it prior to the overlay. Recently when I try to run an alignment of two molecules with only one being selected, I get the following error:


"At least two molecules are required to align."


 


The alignment proceeds as usual when neither molecule is selected, and also when both molecules are selected, but the error appears whenever one is selected and the other is not.

ChemAxon d51151248d

02-11-2015 14:42:45

Hi, 


Thank you for sending us this issue. It is indeed a bug due to a new calculation feature we have recently introduced in Marvin. We will fix this issue soon. We will notify you when the fix is ready.


Best regards, 


Daniel

ChemAxon d51151248d

05-11-2015 10:01:02

Hi, 


This bug has been fixed. The fix will be available in the next week's release.


Best regards, 


Daniel