1,444 search results for “computational chemistry” in the Public website
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‘The first quantum computer will fill a sports hall’
The worldwide race to the quantum computer is in full swing. This computer can bring about a breakthrough in discovering medicines and new materials. Leiden researchers, together with the TU Delft, are taking part in the race. There is now a dossier online about their work.
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Quantum computing pioneer Seth Lloyd is the 2019 Lorentz Professor
American physicist and quantum computing pioneer Seth Lloyd is the 65th Lorentz professor. He will deliver the Ehrenfest lecture on 5 June, and several more lectures on quantum computing on 11, 18 and 25 June.
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Master Computer Science in Leiden nr.1 according to Elsevier
Master Computer Science in Leiden nr.1 according to Elsevier
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From Descriptive to Predictive Pharmacology in Children using Semi-Physiological population modelling
An integrated approach of physiological concepts, advanced statistical approaches and large clinical datasets.
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Education
The specialisation Science Communication and Society (SCS) concerns science communication in a broad sense. The program focuses on the link between science and society and covers knowledge and skills in the field of science communication.
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Verifying the correctness of mathematical theorems with a computer
How correct are mathematical theorems? And is all the theory around them correct? To find out, mathematics student Dominique Lawson converted a mathematical theorem into computer language. ‘This allows a computer to understand the theorem and check whether the proof behind it is entirely correct.’ The…
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Multi-dimensional feature and data mining
In this thesis we explore machine and deep learning approaches that address keychallenges in high dimensional problem areas and also in improving accuracy in wellknown problems. In high dimensional contexts, we have focused on computational fluid dynamics (CFD) simulations.
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Digital Transformation: how do children perceive computer science?
Contribute to shaping the content and methods of future computer science education. That is what researchers hope to achieve with the Digital Transformation Research project. The Swiss National Science Foundation awarded 544,000 euros to this four-year project in December. The project will map the ideas…
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Computer scientists from Leiden and Eindhoven optimise building designs
The design process of new buildings is extremely complex due to strict requirements. Computer models are used to create the designs. Scientists from LIACS developed advanced algorithms that help their colleagues at Eindhoven University of Technology to optimise these models.
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Topology and Geometry in Chiral Liquids
We study the interplay of topology and geometry with chirality for several passive and active systems, employing both analytical and numerical methods.
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Visual analytics for spatially-resolved omics data at single cell resolution: Methods and Applications
The deeper understanding of an organism's pathology is important for developing treatments. Over centuries of systematic research, clinical researchers have demonstrated that the more information they acquire about the cellular properties and their organisation in the tissue, the better they can understand…
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Astrolinguistics
Design of a Linguistic System for Interstellar Communication Based on Logic
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Deep learning for visual understanding
With the dramatic growth of the image data on the web, there is an increasing demand of the algorithms capable of understanding the visual information automatically.
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Computer Science: half in Beijing and half in Leiden
Leiden University and the Beijing Institute of Technology will be collaborating in the area of computer science teaching and research. One of the first outcomes of this collaboration will be a joint four-year bachelor's programme. Willem te Beest, Vice-President of the Executive Board, and Professor…
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Felienne Hermans explains why you should talk to your computer
Why should you talk to your computer? When children start learning how to read, they do so by using their voice and speaking the words out loud. In this lecture for the University of the Netherlands, Felienne Hermans (Leiden University) explains how speaking a computer code out loud can help children…
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Teaching
At Molecular Physiology we teach the following courses within the Leiden Institute of Chemistry's Chemistry and Life Science and Technology programmes.
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Student project Computer Science for Volvo Ocean Race
Seven bachelor students in Computer Science at Leiden University are participating in a research project on big data and event management. Their work should eventually result in a system that can be applied at the finish of the Volvo Ocean Race in The Hague in June next year.
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Computer science research in Leiden of major relevance to society
An international committee has assessed computer science research at all Dutch universities in the period 2009-2014. For its computer science research, Leiden was awarded the ‘highest’ mark (1) for relevance to society.
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Interfacing the past
Computer applications and quantitative methods in archaeology CAA95.
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Contact
The Faculty of Science is housed in various buildings situated in the Bio Science Park Leiden.
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Thiosugars: reactivity, methodology and applications
Carbohydrates, alongside proteins and nucleic acids, constitute a crucial and versatile family of biomolecules present in all life forms. They manifest as monosaccharides, oligosaccharides, and polysaccharides, covalently bonded to proteins and fats. Carbohydrates are integral to plant and arthropod…
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Caging ruthenium complexes with non-toxic ligands for photoactivated chemotherapy
The main goal of the research described in this thesis was the development of new photoactivated chemotherapy (PACT) ruthenium(II) complexes bearing a non-toxic photolabile ligand.
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Computer scientist Frank Takes Teacher of the Year
Students of the Science Faculty of Leiden University have chosen Frank Takes, researcher and teacher at the Leiden Institute of Advanced Computer Science, to be the Teacher of the Year. Impressively enough, Takes also became the runner up Discoverer of the Year.
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History
Life Sciences Artificial Intelligence Data Science
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Teaching synthetic molecules how to communicate
Although Sander Wezenberg just started working in Leiden in March this year, he already managed to win a Vidi grant from NWO. Inspired by nature, Wezenberg wants to bring synthetic molecules to life and teach them to communicate. But who exactly is Wezenberg and what drives him?
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New IBL-professor in "Computational Biology": Vera van Noort
Vera van Noort has been appointed Professor in the field of Computational Biology within the Faculty of Science at the Institute of Biology from the 1st of February 2017. Van Noort’s expertise is in bioinformatics and her research focuses on the computational analysis of large-scale biological data…
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Life work award for computer scientist Grzegorz Rozenberg
Leiden prof. emeritus Grzegorz Rozenberg is honoured with the first life time award in formal languages, a research area of theoretical computer science. During a small ceremony at his house, he received a statue that was specially made for the occasion.
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Science
There are eight institutes at the Faculty of Mathematics and Natural Sciences:
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Six Computer Science master students excel and go to Oxford
Six master students of the Computer Science programme will present their papers on future cities at the NetMob conference in Oxford. The six papers were part of the international Future Cities Challenge and made it to the top 10 of all entries.
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Elmer Maurits
Science
e.maurits@lic.leidenuniv.nl | +31 71 527 2727
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Anthe Janssen
Science
a.p.a.janssen@lic.leidenuniv.nl | +31 71 527 4362
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Jorrit Smit
Faculteit der Sociale Wetenschappen
j.p.smit@cwts.leidenuniv.nl | +31 71 527 2727
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Computer models chart extensive Caribbean inter-island networks
The precolonial inhabitants of the Caribbean islands communicated, travelled, and exchanged objects and ideas along an expansive inter-island network. New methods of computer modeling shed light on these networks. Emma Slayton is set to discuss her work on this topic at her Defense on the 12th of Se…
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Horses and Computers - First Year LIACS Student Wins KHMW Prize
Winning an award at the start of your studies? No problem! Lieke Vertegaal is 20 years old and a first-year Computer Science student at Leiden University. On November 29, 2021, the Royal Dutch Academy of Sciences (KHMW) awarded her a Young Talent incentive award.
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College or university? Computer science students in the right place
The right student in the right place. That is what LIACS program director Frank Takes and education coordinator Joyce Glerum are aiming to do with the ‘Wisselstroom’ project. By next year, they hope to have a standardized protocol that will make it easier for computer science students to transfer from…
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Simulating the prehistoric use of fire through computer models
Archaeologists often use the percentages of heat-affected stone or bone artifacts found at archaeological sites as a way to determine how frequently fire was used by the inhabitants. Andrew Sorensen and Fulco Scherjon have come up with a computer model called 'fiReproxies' to simulate how fires used…
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Computer science students second-best in national hacking competition
On September 7, the Leiden Institute of Advanced Computer Science participated with a team of six students in the first edition of the Capture the Flag event 'Challenge the Cyber'. They were placed second in this national hacking competition for students.
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Assistant Professor in Protein Design
Science, Leiden Institute of Chemistry (LIC)
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The quantum computer: it doesn't exist yet, but still we understand increasingly better what problems it can solve
How do we know what a quantum computer is good for when it hasn't been built yet? That's what PhD candidate Casper Gyurik investigated by combining two terms you often hear: quantum computing and machine learning.
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Flat but not shallow. Towards flatter representations in deep semantic parsing for precise and feasible inferencing
Simulating human language understanding on the computer is a great challenge. A way to approach it is to represent natural language meanings in logic, and to use logical provers to determine what does and does not follow from a text. What logic is best to use and how natural language meanings are best…
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Article on Affective Computing by Andreas Häuselmann published in IDPL
Affective Computing (AC and sometimes called ‘Emotional AI’) provides opportunities to automatically process emotional data. However, is EU data protection law fit for purpose when it is applied to such AC approaches?
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Article on Affective Computing by Andreas Häuselmann published in IDPL
Affective Computing (AC and sometimes called ‘Emotional AI’) provides opportunities to automatically process emotional data. However, is EU data protection law fit for purpose when it is applied to such AC approaches?
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Granted STW Project: Energy Efficient Computer-Brain Interaction
The STW project Energy Efficient Computer-Brain Interaction (principal investigator for LIACS: dr. T.P. Stefanov) has been granted. Funding for LIACS: 1 PhD student + travel/equipment budget, project duration: 4 years.
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Redox Interconversion between Metal Thiolate and Disulfide Compounds
In the last decade, the redox interconversion between metal thiolate and disulfide compounds has been extensively investigated for copper, but not for other transition metal ions.
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Inhibitors and probes targeting mannanases
This thesis describes the synthesis and biochemical evaluation of a variety of cyclophellitol based activity-based probes and inhibitors targeting various endo- and exo-acting retaining glycosidases. In the last two decades a variety of probes and inhibitors for (hemi)cellulose degrading enzymes have…
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The electrochemical reduction of dioxygen and hydrogen peroxide by molecular copper catalysts
The electrochemical oxygen reduction reaction (ORR) is an essential half-reaction for the utilization of hydrogen as a sustainable fuel, via the conversion of hydrogen to electrons and protons facilitated by the ORR. In the most common fuel cells, the ORR is requires high loadings of non-abundant platinum…
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Why Leiden University?
Our programmes are known for our scientifically based education and for our open atmosphere.
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Why Leiden University?
Our programmes are known for our scientifically based education and for our open atmosphere.
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Why Leiden University?
Our programmes are known for our scientifically based education and for our open atmosphere.
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Why Leiden University?
Our programmes are known for our scientifically based education and for our open atmosphere.