Accelrys Workshop, CINECA, Dec 1-2 2005

[Andrew Emerson]

Accelrys MS Modeling workshop
CINECA, Casalecchio di Reno (BO).
1-2 December (2 days)


The workshop will consist of seminars followed by hands-on practical
sessions (see the programme below).
Registration is free but places are limited so those wishing to attend must
send an email to the following address (as soon as possible):

a.emerson a cineca.it

best wishes
Andrew Emerson

===========================
Course agenda – Day 1

9.00 - 9.30 Presentation - Overview of Materials Studio (lecture)
9.35 – 10.15 Sketching hands-on exercises
10.15 – 10.30 Break
10.30 – 11.30 Introduction to Molecular Mechanics (lecture )
11.30 – 1.00 Molecular Dynamics hands-on exercises
1.00 – 2.00 Lunch
2.00 – 2.35 Introduction to Amorphous Cell (lecture )
2.35 – 3.30 Amorphous Cell hands-on exercises
3.30- 3.45 Break
3.45 – 5.00 Amorphous Cell hands-on exercises


Course agenda – Day 2

9.00 - 9.15 Amorphous Cell hands-on exercises (analyse overnight
results)
9.15 – 10.15 Introduction to DMol3 (lecture)
10.15 - 10.30 Break
10.30 – 1.00 DMol3 hands-on exercises
1.00 – 2.00 Lunch
2.00 – 3.00 Introduction Semi-empirical Methods - VAMP (lecture)
3.00 - 3.15 Break
3.15 – 4.15 VAMP hands-on exercises
4.15 - 5.00 Open session



------------------------
Dr Andrew Emerson
CINECA (High Performance Systems)
via Magnanelli, 6/3
40033 Casalecchio di Reno (BO)-ITALY
tel: +39-051-6171653, fax: +39-051-6132198
e-mail: a.emerson a cineca.it