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Institut de Química Computacional i Catàlisi (2013- )
The Institute of Computational Chemistry and Catalysis (IQCC) is a worldwide reference unit in computational chemistry and catalysis that aims at carrying out groundbreaking research on predictive chemistry for catalysis, with special focus on the processes occurring at the confined space for the coming years.
If you are a doctor of Universitat de Girona and you want to publish your thesis at TDX, contact with tdx@udg.edu.
Recent Submissions
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(Date of defense: 13-12-2016)The increasing need for more efficient synthetic methods and sustainable processes for fuel and high-value organic molecules production can be seen as one of the major challenging goals for the future. Nature has developed ...
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Supramolecular nanocapsules as platforms for molecular recognition and reactivity in confined spaces (Date of defense: 23-07-2020)The use of self-assembly to bring simple building blocks together into complex product, has led to the preparation of an increasing number of sophisticated and functional 3D supramolecular nanocapsules. By understanding ...
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(Date of defense: 10-12-2021)The oxidative activation of C(sp3)–H bonds under ambient conditions represents a challenge to modern chemistry, nevertheless it is commonly operated in Nature by various oxygenases in key metabolic transformation and ...
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(Date of defense: 26-03-2021)Given the existing problem of Climate Change, we must work towards more environmentally friendly chemical processes that would help us solve it. The thesis focuses on the study of different chemical reactions involved in ...
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(Date of defense: 12-02-2021)Enzymes are sophisticated biomacromolecules whose function is linked to its three-dimensional structure and conformational dynamics. Therefore, the understanding of enzyme conformational dynamics can be exploited to ...
