|
週次 |
日期 |
單元主題 |
|
Week 1 |
09/15 |
Introduction to advanced computer-aided drug design |
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Week 2 |
09/22 |
中秋節放假 |
|
Week 3 |
09/29 |
The Forces between Molecules. |
|
Week 4 |
10/06 |
Balls on Springs/Molecular Mechanics |
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Week 5 |
10/13 |
Basic of File Format and Pymol |
|
Week 6 |
10/20 |
The Molecular Potential Energy Surface |
|
Week 7 |
10/27 |
Molecular Mechanics Examples(1) |
|
Week 8 |
11/03 |
Molecular Mechanics Examples(2) |
|
Week 9 |
11/10 |
Sharing Out the Energy
(program demo: AutoDock 林芳宇) |
|
Week 10 |
11/17 |
Introduction to Statistical Thermodynamics
(program demo: Swiss‐PdbViewer 王品蒨) |
|
Week 11 |
11/24 |
Force Fields
(program demo: MODELLER 林澤豪) |
|
Week 12 |
12/01 |
Nonbonded Computations & Mid‐semester idea present
(program demo: VMD 陳洋廷) |
|
Week 13 |
12/08 |
Multivariate Minimization in Computational Chemistry
(program demo: NAMD 邵祈諭) |
|
Week 14 |
12/15 |
Monte Carlo Techniques
(program demo: GROMACS 陳星佐) |
|
Week 15 |
12/22 |
Molecular Dynamics(1) & Prefinal progress(1)
(program demo: WHAT IF 徐國翔) |
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Week 16 |
12/29 |
Molecular Dynamics(2) & Prefinal progress(2) |
|
Week 17 |
01/05 |
Molecular Dynamics(3) |
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Week 18 |
01/12 |
Final |
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Week 19 |
01/19 |
Final project |