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Quick Facts

Medium Of InstructionsMode Of LearningMode Of Delivery
EnglishSelf StudyVideo and Text Based

Course Overview

The Computational Chemistry and Classical Molecular Dynamics Certification course is an 8-week certification course designed to provide students with the explanation behind the concept of computational chemistry. Students will also be able to understand the molecular dynamics employed in computational chemistry through the Computational Chemistry and Classical Molecular Dynamics Certification by NPTEL.

Computational Chemistry and Classical Molecular Dynamics training covers key topics including molecular mechanics, material science, and other fundamental concepts. Through the programme, students are engaged through virtual lectures, hands-on learning experiences, and a practical approach to getting a good grasp of the topic.

Also Read: Online Materials Science And Technology Certification Courses

The Highlights

  • IIT Bombay recognised Completion Certificate
  • Learning from Trained Faculty Members
  • Free Course Readings
  • Hands-on projects

Programme Offerings

  • online learning
  • Robust curriculum
  • Hands-on Learning
  • Certified faculty and mentors

Courses and Certificate Fees

Certificate AvailabilityCertificate Providing Authority
yesIIT Bombay

Eligibility Criteria

Academic Qualifications

Students for the Computational Chemistry and Classical Molecular Dynamics certification course are required to attain a bachelor's and a master’s degree.

Certification Qualifying Details

Candidates for the Computational Chemistry and Classical Molecular Dynamics certification course are required to qualify for the final examination to receive the completion certificate.

What you will learn

After completing the Computational Chemistry and Classical Molecular Dynamics Certification syllabus, students will learn essential principles of computational chemistry. They will also develop the skills necessary to explore various applications of computational chemistry, including drug discovery, materials science, and more. The course provides them with deeper insights into computational chemistry and molecular dynamics.


Who it is for

The Computational Chemistry and Classical Molecular Dynamics certification course is designed for professionals interested in deepening their knowledge of molecular dynamics and computational chemistry.

The course is apt for the following professionals:


Admission Details

To join the Computational Chemistry and Classical Molecular Dynamics classes, candidates must follow the below-mentioned steps:

Step 1: Visit the official course URL: 

https://nptel.ac.in/courses/104101095

Step 2: Log in to the website and enrol for the programme. 

Step 3: Enter relevant academic and personal details.

Step 4: Pay the course fee to complete the enrollment process

Step 5: Start learning

Application Details

Aspiring candidates must visit the official course page to enrol in the online Computational Chemistry and Classical Molecular Dynamics Certification Course. After that, they need to complete the enrollment process by entering their details and course fees.

The Syllabus

  • General Introduction and course outline
  • Algorithms Simple programs and the sine function
  • Flow charts, recursion relations and convergence and do loops
  • Branching and if statement. Solving aquadratic equation
  • Quadratic equation, dimension statement
  • Reading and writing from files

  • Execution of simple programs-1

  • Program execution 3

  • Integration

  • Scilab 4

  • Gromacs files-1

  • Results for liquid argon

  • Correlation functions-1

Evaluation process

Candidates for the Computational Chemistry and Classical Molecular Dynamics certification course are required to appear for the examinations to receive the completion certificate.

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