9:00 

10:00 

11:00 

11:30 

12:30 

14:00 

15:30 

16:00 

17:00 

7 July 

  

  

  

  

  

Arrival 

Arrival 

Arrival 

Arrival 

8 July 

Fortran I  

 Python I   

Fortran II   

Python II  

    

 Fortran III   

Python III 

 Lunch   

Practicals 

Practicals 

Practicals 

 

9 July 

Fortran IV  

Python IV     

Fortran V   

Python V     

      

 Fortran VI  

 Python VI   

Lunch  

    

Practicals 

 

Practicals 

 

Practicals 

 

 

10 July 

Overview of molecular simulations 

Statistical Mechanics 1 

Refreshment 

Intro. to Practical session 

Lunch 

Stat mech probs 

Refreshment 

basics 

Prof Mark Wilson 

11 July 

Monte Carlo 1 

Monte Carlo 2 

Refreshment 

Statistical Mechanics 2 

Lunch 

MC integration 

Refreshment 

Intro to MC 

Prof Daan Frenkel

12 July 

Monte Carlo 3 

Introduction to force fields 

Refreshment 

Optimisation methods  

Lunch 

Phase Equilibria 

Refreshment 

Forcefields/optimisation 

Dr Fausto Martelli 

13 July 

Molecular Dynamics 1 

Molecular Dynamics 2 

Refreshment 

Molecular dynamics 3 

Lunch 

Intro to MD 

Refreshment 

Stability + accur MD 

Research Seminar 

14 July 

Free time 

15 July 

Free energy methods 1 

Free energy methods 2 

Refreshment 

Long timescale methods  

Lunch 

Thermostats+ shake 

Refreshment 

Chemical potential 

Prof Marialore Sulpizi 

16 July 

Advanced Seminar 1 

Advanced Seminar 2 

Refreshment 

Advanced Seminar 3 

Lunch 

Practical Session 

Refreshment 

Practical Session 

Dr Misbah Sanwar 

17 July 

Advanced Seminar 4 

Advanced Seminar 5 

Refreshment 

Advanced Seminar 6 

Lunch 

Practical Session 

Refreshment 

Practical Session 

Research Seminar 

18 July 

Advanced Seminar 7 

Practical Session 

Refreshment 

Practical Session 

Lunch 

Practical Session 

Refreshment 

Departure 

  

 

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