Name: Computational Science, Scientific Computing, and Machine Learning Workshop 2025
Start: 2025-10-06T08:00:00+00:00
End: 2025-11-07T19:00:00+00:00
Location: KNUST-College of Science

Monday, 6 October 2025
08:30 Lecture - Introduction to Scientific computing and Linux
Lecture - Introduction to Scientific computing and Linux
08:30 - 10:30
Room: Lab-SF14
Contributions

08:30 Introduction to Scientific computing and Linux - Daniella Apeadu (Kwame Nkrumah University of Science and Technology, Department of Mathematics) Elliot Menkah (Chemistry Department)
10:30 Lunch break
Lunch break
10:30 - 11:10
Room: Lab-SF14

11:10 Handson1 - Introduction to Scientific computing and Linux
Handson1 - Introduction to Scientific computing and Linux
11:10 - 13:00
Room: Lab-SF14
Tuesday, 7 October 2025
08:30 Introduction to Scientific computing and Linux.
Introduction to Scientific computing and Linux.
08:30 - 09:45
Room: Lab-SF14
Contributions

08:30 Command Line tools and File operations - Daniella Apeadu (Kwame Nkrumah University of Science and Technology, Department of Mathematics) Elliot Menkah (Chemistry Department)
09:45 Hands-On for Command Line Tools and file operations
Hands-On for Command Line Tools and file operations
09:45 - 11:45
Room: Lab-SF14

11:45 Lunch Break
Lunch Break
11:45 - 12:30
Room: Lab-SF14

12:30 Hands-on - Command Line tools and File operations
Hands-on - Command Line tools and File operations
12:30 - 14:00
Room: Lab-SF14
Wednesday, 8 October 2025
08:30 Lecture - Advanced Shell tools: AWK, SED, etc ..
Lecture - Advanced Shell tools: AWK, SED, etc ..
08:30 - 09:45
Room: Lab-SF14
Contributions

08:30 Advanced Shell tools: AWK, SED, etc .. - Daniella Apeadu (Kwame Nkrumah University of Science and Technology, Department of Mathematics) Elliot Menkah (Chemistry Department)
09:45 Hands-On : Advanced Commands
Hands-On : Advanced Commands
09:45 - 11:45
Room: Lab-SF14

11:45 Lunch Break
Lunch Break
11:45 - 12:30
Room: Lab-SF14

12:30 Hands-On
Hands-On
12:30 - 14:00
Room: Lab-SF14
Thursday, 9 October 2025
08:30 Lecture - Introduction to Text editing and Shell scripting
Lecture - Introduction to Text editing and Shell scripting
08:30 - 09:45
Room: Lab-SF14
Contributions

08:30 Introduction to Text editing and Shell scripting - Daniella Apeadu (Kwame Nkrumah University of Science and Technology, Department of Mathematics) Elliot Menkah (Chemistry Department)
09:45 Hands-on for Introduction to Text editing and Shell scripting
Hands-on for Introduction to Text editing and Shell scripting
09:45 - 11:45
Room: Lab-SF14

11:45 Lunch break
Lunch break
11:45 - 12:30
Room: Lab-SF14

12:30 Hands-on for Introduction to Text editing and Shell scripting
Hands-on for Introduction to Text editing and Shell scripting
12:30 - 14:00
Room: Lab-SF14
Friday, 10 October 2025
08:30 Introduction to plotting with Gnuplot
Introduction to plotting with Gnuplot
08:30 - 09:45
Room: Lab-SF14
Contributions

08:30 Introduction to plotting with Gnuplot - Daniella Apeadu (Kwame Nkrumah University of Science and Technology, Department of Mathematics) Elliot Menkah (Chemistry Department)
09:45 Hands-on for Introduction to plotting with Gnuplot
Hands-on for Introduction to plotting with Gnuplot
09:45 - 11:45
Room: Lab-SF14

11:45 Lunch break
Lunch break
11:45 - 12:30
Room: Lab-SF14

12:30 Hands-on for Introduction to plotting with Gnuplot
Hands-on for Introduction to plotting with Gnuplot
12:30 - 14:00
Room: Lab-SF14
Saturday, 11 October 2025
Sunday, 12 October 2025

Monday, 13 October 2025
08:30 Lecture - Introduction to Python Programming
Lecture - Introduction to Python Programming
08:30 - 09:45
Room: Lab-SF14
Contributions

08:30 Introduction to Python Programming - Daniella Apeadu (Kwame Nkrumah University of Science and Technology, Department of Mathematics) Elliot Menkah (Chemistry Department)
09:45 Hands-on for Introduction to Python Programming
Hands-on for Introduction to Python Programming
09:45 - 11:45
Room: Lab-SF14

11:45 Lunch break
Lunch break
11:45 - 12:30
Room: Lab-SF14

12:30 Hands-on for Introduction to Python Programming
Hands-on for Introduction to Python Programming
12:30 - 14:00
Room: Lab-SF14
Tuesday, 14 October 2025

08:30 Lecture - Programming Logic, Data Structures, and Functions
Lecture - Programming Logic, Data Structures, and Functions
08:30 - 09:45
Room: Lab-SF14

09:45 Hands-on for Programming Logic, Data Structures, and Functions
Hands-on for Programming Logic, Data Structures, and Functions
09:45 - 11:45
Room: Lab-SF14

11:45 Lunch break
Lunch break
11:45 - 12:30
Room: Lab-SF14

12:30 Hands-on for Programming Logic, Data Structures, and Functions
Hands-on for Programming Logic, Data Structures, and Functions
12:30 - 14:00
Room: Lab-SF14
Wednesday, 15 October 2025

08:30 Lecture - Numerical and Scientific Python
Lecture - Numerical and Scientific Python
08:30 - 09:45
Room: Lab-SF14

09:45 Hands-on for Numerical and Scientific Python
Hands-on for Numerical and Scientific Python
09:45 - 11:45
Room: Lab-SF14

11:45 Lunch break
Lunch break
11:45 - 12:30
Room: Lab-SF14

12:30 Hands-on for Numerical and Scientific Python
Hands-on for Numerical and Scientific Python
12:30 - 14:00
Room: Lab-SF14
Thursday, 16 October 2025

08:30 Lecture - Machine learning
Lecture - Machine learning
08:30 - 09:45
Room: Lab-SF14

09:45 Hands-on for Machine learning
Hands-on for Machine learning
09:45 - 11:45
Room: Lab-SF14

11:45 Lunch break
Lunch break
11:45 - 12:30
Room: Lab-SF14

12:30 Hands-on for Machine learning
Hands-on for Machine learning
12:30 - 14:00
Room: Lab-SF14
Friday, 17 October 2025

08:30 Lecture - Machine learning
Lecture - Machine learning
08:30 - 09:45
Room: Lab-SF14

09:45 Hands-on for Machine learning
Hands-on for Machine learning
09:45 - 11:45
Room: Lab-SF14

11:45 Lunch break
Lunch break
11:45 - 12:30
Room: Lab-SF14

12:30 Hands-on for Machine learning
Hands-on for Machine learning
12:30 - 14:00
Room: Lab-SF14
Saturday, 18 October 2025
Sunday, 19 October 2025

Monday, 20 October 2025

08:30 Lecture - Machine learning
Lecture - Machine learning
08:30 - 09:45
Room: Lab-SF14

09:45 Hands-on for Machine learning
Hands-on for Machine learning
09:45 - 11:45
Room: Lab-SF14

11:45 Lunch break
Lunch break
11:45 - 12:30
Room: Lab-SF14

12:30 Hands-on for Machine learning
Hands-on for Machine learning
12:30 - 14:00
Room: Lab-SF14
Tuesday, 21 October 2025

08:30 Lecture - Molecular Mechanics
Lecture - Molecular Mechanics
08:30 - 09:45
Room: Lab-SF14

09:45 Hands-on for Molecular Mechanics
Hands-on for Molecular Mechanics
09:45 - 11:45
Room: Lab-SF14

11:45 Lunch break
Lunch break
11:45 - 12:30
Room: Lab-SF14

12:30 Hands-on for Molecular Mechanics
Hands-on for Molecular Mechanics
12:30 - 14:00
Room: Lab-SF14
Wednesday, 22 October 2025

08:30 Lecture - Molecular Mechanics
Lecture - Molecular Mechanics
08:30 - 09:45
Room: Lab-SF14

09:45 Hands-on for Molecular Mechanics
Hands-on for Molecular Mechanics
09:45 - 11:45
Room: Lab-SF14

11:45 Lunch break
Lunch break
11:45 - 12:30
Room: Lab-SF14

12:30 Hands-on for Molecular Mechanics
Hands-on for Molecular Mechanics
12:30 - 14:00
Room: Lab-SF14
Thursday, 23 October 2025

08:30 Lecture - Molecular Mechanics
Lecture - Molecular Mechanics
08:30 - 09:45
Room: Lab-SF14

09:45 Lecture - Molecular Mechanics
Lecture - Molecular Mechanics
09:45 - 11:45
Room: Lab-SF14

11:45 Lunch break
Lunch break
11:45 - 12:30
Room: Lab-SF14

12:30 Lecture - Molecular Mechanics
Lecture - Molecular Mechanics
12:30 - 14:00
Room: Lab-SF14
Friday, 24 October 2025

08:30 Lecture - Materials Research
Lecture - Materials Research
08:30 - 09:45
Room: Lab-SF14

09:45 Hands-on for Materials Research
Hands-on for Materials Research
09:45 - 11:45
Room: Lab-SF14

11:45 Lunch break
Lunch break
11:45 - 12:30
Room: Lab-SF14

12:30 Hands-on for Materials Research
Hands-on for Materials Research
12:30 - 14:00
Room: Lab-SF14
Saturday, 25 October 2025
Sunday, 26 October 2025

Monday, 27 October 2025

08:30 Lecture - Materials Research
Lecture - Materials Research
08:30 - 09:45
Room: Lab-SF14

09:45 Hands-on for Materials Research
Hands-on for Materials Research
09:45 - 11:45
Room: Lab-SF14

11:45 Lunch break
Lunch break
11:45 - 12:30
Room: Lab-SF14

12:30 Hands-on for Materials Research
Hands-on for Materials Research
12:30 - 14:00
Room: Lab-SF14
Tuesday, 28 October 2025

08:30 Lecture - Materials Research
Lecture - Materials Research
08:30 - 09:45
Room: Lab-SF14

09:45 Hands-on for Materials Research
Hands-on for Materials Research
09:45 - 11:45
Room: Lab-SF14

11:45 Lunch break
Lunch break
11:45 - 12:30
Room: Lab-SF14

12:30 Hands-on for Materials Research
Hands-on for Materials Research
12:30 - 14:00
Room: Lab-SF14
Wednesday, 29 October 2025

08:30 Lecture - Molecular Dynamics and Docking
Lecture - Molecular Dynamics and Docking
08:30 - 09:45
Room: Lab-SF14

09:45 Hands-on for Molecular Dynamics and Docking
Hands-on for Molecular Dynamics and Docking
09:45 - 11:45
Room: Lab-SF14

11:45 Lunch break
Lunch break
11:45 - 12:30
Room: Lab-SF14

12:30 Hands-on for Molecular Dynamics and Docking
Hands-on for Molecular Dynamics and Docking
12:30 - 13:30
Room: Lab-SF14
Thursday, 30 October 2025

08:30 Lecture - Molecular Dynamics and Docking
Lecture - Molecular Dynamics and Docking
08:30 - 09:45
Room: Lab-SF14

09:45 Hands-on for Molecular Dynamics and Docking
Hands-on for Molecular Dynamics and Docking
09:45 - 11:45
Room: Lab-SF14

11:45 Lunch break
Lunch break
11:45 - 12:30
Room: Lab-SF14

12:30 Hands-on for Molecular Dynamics and Docking
Hands-on for Molecular Dynamics and Docking
12:30 - 13:30
Room: Lab-SF14
Friday, 31 October 2025

08:30 Presentation
Presentation
08:30 - 11:45
Room: Lab-SF14

11:45 Lunch break
Lunch break
11:45 - 12:30
Room: Lab-SF14

12:30 Presentation
Presentation
12:30 - 14:00
Room: Lab-SF14
Saturday, 1 November 2025
Sunday, 2 November 2025

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