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Week
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Topics
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Study Metarials
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1
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Introduction to molecular modeling
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R1-CHAPTER 1
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2
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Molecular graphics applications
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R1-CHAPTER 2
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3
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Molecular mechanics
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R2-CHAPTER 2
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4
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Calculation of molecular properties by ab-initio methods
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R2-CHAPTER 3
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5
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Calculation of molecular properties by semi-emperical methods
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R1-CHAPTER 4
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6
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Energy minimization
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R1-CHAPTER 5
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7
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Hansch Analysis
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R3-CHAPTER 2
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8
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Pharmacophore identification and drug design methods
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R3-CHAPTER 3
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9
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2-D and 3-D database scanning
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R3-CHAPTER 4
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10
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Regression analysis
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R4-CHAPTER 2
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11
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Statistical data analysis
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R4-CHAPTER 3
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12
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Structure-based drug design I
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R4-CHAPTER 4
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13
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Structure-based drug design II
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R4-CHAPTER 4
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14
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Structure-based drug design III
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R4-CHAPTER 4
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