Office of Advanced Research Computing
A Rutgers IT Service
- This event has passed.
Molecular Operating Environment (MOE) user training session 2
October 25, 2022 @ 10:00 am - 12:00 pm
OARC in collaboration with Chemical Computing Group (CCG), continue MOE training sessions.
Session 1 was completed at the end of May, 2022.
Session 2 is scheduled for Tuesday, Oct 25, 2022 10:00 AM ET.
- Session 2 will focus on Advanced Structure-Based Design:
- pharmacophore modeling
- docking
- fragment-based design
- scaffold replacement
- R-group screening
- project search
- protein-ligand interaction fingerprints (PLIF)
This hands-on webinar can be followed with MOE installed on Amarel cluster or you may install it on your own computer from the Rutgers Software Portal.
Alternatively you may listen to the presenters during the webinar and repeat tutorials later on your own.
If interested, please register here.
If you have any questions or need help please email Vlad Kholodovych at OARC or Mauricio Rodriguez, Academic Services Manager at Chemical Computing Group.