|
Dear Charles,
In ensemble calculation, is it possible that the ensemble members have different initial structures rather than share the same one?
If feasible, could you please give me an example to show how to assign different initial structures.
By the way, is there any trick to make the ensemble members more diverse? In my case, they always don't differ enough as I expect.
Thanks & regards,
Liu Wei
Important: This email is confidential and may be privileged. If you are not the intended recipient, please delete it and notify us immediately; you should not copy or use it for any purpose, nor disclose its contents to any other person. Thank you. |
_______________________________________________ Xplor-nih mailing list [email protected] https://dcb.cit.nih.gov/mailman/listinfo/xplor-nih
