Ujio wa kozi ya Digital Chemistry

[Mkurugenzi Wa Mashirika]

Digital chemistry, au kemia ya kidijitali, inahusu matumizi ya teknolojia ya digitali kuchunguza na kuelewa mifumo ya kikemia. Hii inaweza kujumuisha utumiaji wa programu za kompyuta, algorithms, na teknolojia zingine za digitali kusaidia katika uchambuzi wa kimatibabu, maendeleo ya dawa, na utafiti wa kisayansi.

Katika muktadha wa digital chemistry, wataalamu wa kemia wanaweza kutumia modeling ya kompyuta (kutumia mifano ya kompyuta kuiga mifumo ya kikemia), computational chemistry (matumizi ya taratibu za kompyuta kuchambua mifumo ya kikemia), na simulation (kuanzisha mazingira ya majaribio katika mazingira ya digitali) ili kufanya utafiti wao. Hii inaweza kusaidia katika kuelewa mwingiliano wa molekuli, maendeleo ya dawa mpya, na hata kuelewa mifumo ya biokemia katika mwili wa binadamu.

Kemia ya kidijitali inaweza kuwa na jukumu kubwa katika maendeleo ya dawa mpya, kwani inaruhusu watafiti kutambua molekuli inayoweza kuwa na athari nzuri katika matibabu ya magonjwa mbalimbali kupitia mifumo ya kompyuta kabla ya kufanya majaribio ya kimwili, ambayo inaweza kuokoa muda na rasilimali.

Pia, digital chemistry inaweza kutumika katika viwanda kama vile sekta ya vifaa vya elektroniki na vifaa vingine vya hali ya juu ambapo utaalamu wa kemia unaweza kusaidia katika kuboresha utendaji wa vifaa na kusaidia katika uvumbuzi wa bidhaa mpya.

Kwa kifupi, digital chemistry ni uwanja unaokua kwa kasi ambapo teknolojia ya digitali inaunganishwa na ujuzi wa kemia ili kufanya utafiti wa kisayansi na maendeleo ya bidhaa.

Vyuo vinavyofundisha kozi ya Digital chemistry

Digital Chemistry (MSc) University of Southampton​

You must study the following modules :

Artificial Intelligence and Machine Learning in Chemistry​

The aim of the module is to expose the students to modern chemical informatics, machine learning (ML) and artificial intelligence (AI) driven approaches for computational modelling and prediction, illustrated with applications to research in to the discov...

Chemistry MSc Advanced Research Project​

The project involves approximately 600 hours of commitment including 14 weeks of full-time practical-based research work (ca. 450 hours). It commences with literature research and project planning, some of which has been performed in other modules previou...

Chemistry through the Computational Microscope​

This module builds on the student’s core understanding of the structure of atoms and molecules to predict their behaviour using state-of-the art computational chemistry methods. This will involve learning how quantum chemistry methods can be used to st...

Data Management, Numerical Methods and Analysis​

Having learned in semester one how to develop and optimise code to generate new and interesting data, you will now learn how to handle the resulting data and maximise the information retrieved. This module provides training in advanced numerical methods ...

Programming in Python and Software Development​

This module will introduce the basics required to produce efficient and effective code. You will be introduced to the underpinning architecture of a modern computer and from this starting point learn the basic of good computer practice from a code agnosti...

Scientific writing and presentation skills for Chemistry MSc​

This module involves the completion of a literature review in preparation for the student’s MSc dissertation project. The results of the literature review are presented in a written report and in a short oral presentation. To support the preparation of th...
2023-24 - CHEM6162 Advanced Chemical Biology
2023-24 - CHEM6162 Advanced Chemical Biology

Advanced Spectroscopy and Applications​

Modern spectroscopic techniques underpin a wide range of chemical and biological research as well as serving as a valuable analytical tool. This module will introduce some of the key principles, tools and techniques that govern spectroscopic measurements ...

Atoms, Molecules and Spins: Quantum Mechanics in Chemistry and Spectroscopy​

This module aims to develop an intermediate-level understanding of quantum mechanics, including familiarity with its mathematical formulation. It is intended to bridge the gap between the qualitative, pictorial approach used in the core modules of the fir...

Inorganic Materials Chemistry​

Nuclear Magnetic Resonance Spectroscopy​

Supramolecular Chemistry of Functional Molecules and Materials​

This module will explore the fundamental basis of intermolecular interactions and illustrate how these can be exploited to form diverse supramolecular assemblies ranging from small molecules, soft gels and hard extended inorganic solids. The course will p...

Sustainable Chemistry​

Digital Chemistry (MSc) Imperial College London​

Core modules​

Data Analytics in Chemistry​

Uncover the basics of statistics and machine learning and learn how to make predictive models.

‘Hacking’ for Chemists​

Develop your knowledge of hardware prototyping and employ rapid prototyping techniques.
This module will take place in ‘Lab-in-a-Box' format.

Automation in Chemistry, Drug Discovery and Materials​

Review state-of-the-art ‘enabling technologies’ and explore low-cost open-source automated systems.

Ethics in Data Science and Artificial Intelligence​

Investigate the ethical implications of the new capabilities offered by data science and artificial intelligence.

Journal Club​

Attend weekly meetings to discuss current relevant research, and introduce, highlight and critique this work.

Artificial Intelligence in Chemistry: Materials​

Consider the in silico design of materials problems and apply computational methods and machine learning to chemical/materials problems.

Artificial Intelligence in Chemistry: Drug Discovery​

Analyse recent advances in artificial intelligence systems that improve a design hypothesis through feedback analysis.

Design of Experiments (DoE)​

Explore the practical tools which help scientists and engineers design sets of experiments which efficiently provide information about the system being studied.