Spring School in Computational Chemistry 2016 @ CSC
from
Tuesday, March 8, 2016 (9:00 AM)
to
Friday, March 11, 2016 (3:15 PM)
Monday, March 7, 2016
Tuesday, March 8, 2016
9:00 AM
Welcome and Introduction
9:00 AM - 9:15 AM
Room: Training room Dogmi, 1st floor
9:15 AM
Introduction to Classical MD
9:15 AM - 10:00 AM
Room: Training room Dogmi, 1st floor
10:00 AM
Coffee break
Coffee break
10:00 AM - 10:15 AM
Room: CSC training lobby
10:15 AM
Introduction to Classical MD
10:15 AM - 11:00 AM
Room: Training room Dogmi
11:00 AM
Break
Break
11:00 AM - 11:15 AM
Room: CSC training lobby
11:15 AM
Introduction to Classical MD
11:15 AM - 12:00 PM
12:00 PM
Lunch
Lunch
12:00 PM - 1:00 PM
Room: Restaurant, Life Science Center Keilaniemi
1:00 PM
Using CSC's environment
1:00 PM - 1:15 PM
Room: Training room Dogmi
1:15 PM
MD workshop (advanced)
1:15 PM - 2:30 PM
Room: TBA
MD workshop (basics)
1:15 PM - 2:30 PM
Room: TBA
MD workshop (intermediate)
1:15 PM - 2:30 PM
Room: TBA
2:30 PM
Coffee break
Coffee break
2:30 PM - 3:00 PM
Room: CSC training lobby
3:00 PM
MD workshop (advanced)
3:00 PM - 4:30 PM
Room: TBA
MD workshop (basics)
3:00 PM - 4:30 PM
Room: TBA
MD workshop (intermediate)
3:00 PM - 4:30 PM
Room: TBA
4:30 PM
Break
Break
4:30 PM - 4:45 PM
Room: CSC training lobby
4:45 PM
Wrap-up discussion
4:45 PM - 5:00 PM
Room: Training room Dogmi
5:00 PM
Poster session
5:00 PM - 7:00 PM
Room: CSC training lobby
Wednesday, March 9, 2016
9:15 AM
Introduction to electronic-structure theory
9:15 AM - 10:00 AM
Room: Training room Dogmi
10:00 AM
Coffee break
Coffee break
10:00 AM - 10:15 AM
Room: Training lobby
10:15 AM
Introduction to electronic-structure theory
10:15 AM - 11:00 AM
Room: Training room Dogmi
11:00 AM
Break
Break
11:00 AM - 11:15 AM
Room: CSC training lobby
11:15 AM
Introduction to electronic-structure theory
11:15 AM - 12:00 PM
Room: Training room Dogmi
12:00 PM
Lunch
Lunch
12:00 PM - 1:00 PM
Room: Restaurant, Life Science Center Keilaniemi
1:00 PM
QC workshop (advanced)
1:00 PM - 2:30 PM
Room: TBA
QC workshop (basics)
1:00 PM - 2:30 PM
Room: TBA
QC workshop (intermediate)
1:00 PM - 2:30 PM
Room: TBA
2:30 PM
Coffee break
Coffee break
2:30 PM - 3:00 PM
Room: CSC training lobby
3:00 PM
QC workshop (advanced)
3:00 PM - 4:45 PM
Room: TBA
QC workshop (basics)
3:00 PM - 4:45 PM
Room: TBA
QC workshop (intermediate)
3:00 PM - 4:45 PM
Room: TBA
4:45 PM
Wrap-up discussion
4:45 PM - 5:00 PM
Room: Training room Dogmi
Thursday, March 10, 2016
9:15 AM
Machine learning introduction (includes hands-on exercises)
9:15 AM - 10:00 AM
Room: Training room Dogmi
10:00 AM
Coffee break
Coffee break
10:00 AM - 10:15 AM
Room: CSC training lobby
10:15 AM
Machine learning introduction (continued)
10:15 AM - 11:00 AM
Room: Training room Dogmi
11:00 AM
Break
Break
11:00 AM - 11:15 AM
Room: CSC training lobby
11:15 AM
Machine learning introduction (continued)
11:15 AM - 12:00 PM
Room: Training room Dogmi
12:00 PM
Lunch
Lunch
12:00 PM - 1:00 PM
Room: Restaurant, Life Science Center Keilaniemi
1:00 PM
Visualizing your results. An introduction to VMD (hands-on)
1:00 PM - 2:30 PM
Room: Training room Dogmi
2:30 PM
Coffee break
Coffee break
2:30 PM - 2:45 PM
Room: CSC training lobby
2:45 PM
Visualizing your results. An introduction to VMD (hands-on)
2:45 PM - 4:30 PM
Room: Training room Dogmi
4:30 PM
Break
Break
4:30 PM - 4:45 PM
Room: CSC training lobby
4:45 PM
Scientific Writing
4:45 PM - 5:30 PM
5:30 PM
Sauna evening & dinner
5:30 PM - 8:00 PM
Room: Life Science Center Keilaniemi sauna
Friday, March 11, 2016
9:15 AM
Ab initio molecular dynamics
9:15 AM - 10:00 AM
Room: Training room Dogmi
10:00 AM
Coffee break
Coffee break
10:00 AM - 10:15 AM
Room: CSC training lobby
10:15 AM
Modeling solvent effects
10:15 AM - 11:00 AM
Room: Training room Dogmi
11:00 AM
Break
Break
11:00 AM - 11:15 AM
Room: CSC training lobby
11:15 AM
Accelerated Sampling Techniques
11:15 AM - 12:00 PM
12:00 PM
Lunch
Lunch
12:00 PM - 1:00 PM
Room: Restaurant
1:00 PM
CSC Chemistry service update: Unlimited license for Materials and Discovery Studio, Cloud server access
1:00 PM - 1:15 PM
Room: Training room Dogmi, 1st floor
1:15 PM
General hands on session with CSC's specialists: discuss your own research
1:15 PM - 3:00 PM
Room: Training room Dogmi