User 55ffa2f197
17-07-2015 01:44:42
Hi,
I have been using getChirality in my code for a while, today we notice an instance where in Marvin it shows the atom in question having chirality as R, whereas getChirality returns 8 for this atom. I always thought 8 translates to R. Is my assumption in correct. I cannot attach molecule due to confidentiality.Please let me know.
I also dig out an old posting dated 2005 to report similar odd behavior at using getChirality https://www.chemaxon.com/forum/ftopic464.html
Thanks
Dong
ChemAxon 044c6721bc
17-07-2015 11:53:38
Hi,
Your assumption is correct, 8 means R. In the API you can use the StereoConstants.CHIRALITY_R value expect the value of 8.
Janos
User 55ffa2f197
17-07-2015 12:18:10
thanks, will talk to Volfi today on this issue. It is a bit disturbing if the issue is confirmed.
Dong
ChemAxon 2cd598e7ad
20-07-2015 12:48:58
Hi,
Are you satisfied with results of your consultation with Volfi arranged on friday?
Regards,
Domi
User 55ffa2f197
23-07-2015 15:10:23
Hi Domi,
It is not a bug, it is something I put in caused issue. Sorry for the false alarm.
Thanks
Dong