1,342 search results for “computational chemistry” in the Public website
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Tricking a quantum computer to enhance its performance
Researchers found a way to run programmes that should be impossible to carry out on an imperfect quantum computer. Such programmes are very computationally demanding and the quantum computers that currently exist are not yet up to that task. Unless you use a clever trick, Simon Marshall and Vedran Dunjko…
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ALICE Leiden Computer Cluster
ALICE is Leiden University's newest computing miracle. The computing cluster is a first step in the development of infrastructure for computational and data-intensive research that is accessible to everyone within Leiden University and the LUMC. This includes both experienced users of high-performance…
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Designing the quantum future on a regular computer
Computer scientist Tim Coopmans uses pen, paper and regular computers to simulate the best possible quantum computer. He tells about his research and how this helps make a useful quantum computer a reality a little bit sooner. ‘I hope I will get to see quantum computers contributing something really…
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Fons Verbeek on computational bio-imaging at SleutelstadFM
Professor Fons Verbeek of the computer science and biology institutes at Leiden University has the fascination to visualize everything we can not see immediately. At SleutelstadFM he tells us that by converting 2 dimensional (2D) images to 3 dimensional (3D) structures, research is carried out into…
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Squaramide-based supramolecular polymers
Supramolecular polymers are class of materials that are formed by non-covalent interactions such as hydrogen bonding, π-π interactions, electrostatic interactions and the hydrophobic effect.
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New research shows the limitations of coordination in chemistry
A common assumption in chemistry is that the coordination number of a catalyst's surface determines the reactivity of the reaction it catalyses. Strikingly, Leiden chemists have now proven that this is not true for nature’s most simple chemical reaction: the dissociation of hydrogen. The researchers…
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Chemistry research for better chemotherapy Finalist PNAS paper award
Last year, chemists Dennis Wander and Hermen Overkleeft contributed to an important discovery about a widely used cancer drug. Their research has now been recognised as Finalist for the PNAS Cozzarelli Prize in the Biomedical Sciences class.
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Kan een computer rechtspreken?
Kan een computer in de rechtszaal net zo goed uitspraak doen als een rechter? Hoogleraar Recht en informatica Jaap van den Herik vindt volmondig van wel. Hij legt het uit in een college van de Universiteit van Nederland.
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Photographs & Preservation. How to save Photographic Artwork for the Future?
How can we understand the material instability of photographic (mixed media) artworks (1960s - present) from an integrated approach of Art History, Conservation Science and Chemistry in order to preserve these works for the future?
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About the programme
An attractive feature of the MSc Chemistry programme at Leiden University is the great flexibility of the study programme, allowing students to put together a tailor-made programme following their personal interests. Within the limits set by the programme, students can make their own choices and adjust…
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Applications of quantum annealing in combinatorial optimization
Quantum annealing belongs to a family of quantum optimization algorithms designed to solve combinatorial optimization problems using programmable quantum hardware. In this thesis, various methods are developed and tested to understand how to formulate combinatorial optimization problems for quantum…
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Bioorthogonal Antigens as Tool for Investigation of Antigen Processing and Presentation
In order to be able to develop effective medicine and treatments to prevent or cure autoimmune diseases or cancer we need to understand the mechanisms how they arise and what drives their course.Unravelling the fundamental molecular mechanisms influencing the onset and course of diseases such as allergies,…
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Algorithms for quantum software
Top scientists of three Dutch universities are working on software and systems for quantum computers. Researchers of the Leiden Institute of Advanced Computer Science (LIACS) and the Leiden Institute of Physics (LION) are developing new algorithms to make those super computers work. The coming years,…
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New professor Vedran Dunjko finds real-world problems that a quantum computer can solve
Vedran Dunjko appointed to full professor of quantum computing at Leiden University, the Netherlands.
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Latest hardware for computer research on medical imaging
The LIACS Media Lab has received a research grant from the worldwide leading graphics hardware company NVIDIA. The grant exists of newly developed hardware utilizing thousands of processors. LIACS researchers will use it to investigate deep learning in understanding imagery from sources such as MRI…
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Chemical Biology
Chemical biology research at the Leiden Institute of Chemistry is aimed at understanding biological processes at the molecular level to strengthen the knowledge base of human health and disease. The approach to achieve this goal is a fundamental chemical one; with the aid of chemical probes biological…
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Mario van der Stelt
Science
m.van.der.stelt@chem.leidenuniv.nl | +31 71 527 4768
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Roxanne Kieltyka
Science
r.e.kieltyka@chem.leidenuniv.nl | +31 71 527 4441
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Madeline Kavanagh
Science
m.e.kavanagh@lic.leidenuniv.nl | +31 71 527 3527
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Exploring Open-World Visual Understanding with Deep Learning
We are living in an information era where the amount of image and video data increases exponentially.
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More efficient drug development with the help of computer models
The coronavirus has the world in its grip. Finding a cure has never been more important. Unfortunately, the development of new drugs for treatment of the COVID-19 disease caused by the virus and development of a vaccine are complex, lengthy, and above all costly processes. With the help of computer…
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Dr. Dong Guo won the Dutch Medicinal Chemistry prize 2013-2014
On March 27th, 2015 the biannual Dutch Medicinal Chemistry Prize for the best Dutch Ph.D. thesis in the field was awarded to Dr. Dong Guo, a current postdoc researcher in our lab, by the Section of Medicinal Chemistry of the Royal Netherlands Chemical Society.
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Three Leiden Science projects receive computing time on national supercomputers
A night sky of more than 40 petabytes in size, simulating young star clusters and understanding how the body inhibits viruses: three Leiden projects have received computing time on one of the national computer systems.
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Zwitterionic oligosaccharides: charging the immune system
How are carbohydrates processed by the immune system? Can carbohydrates be used to trigger T-cells against other conjugated antigens? Can they be used as adjuvants?
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The chemistry behind cancer drugs: searching for fewer side effects
PhD candidate Dennis Wander searches for the best of both worlds. That is to say: a cancer drug that is effective and also has minimal side effects. To this end, he makes new molecules inspired by two existing medicines. And not without result: ‘We have created a new variant that is very promising.’…
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Emerging approaches to study cell-cell interactions
The aim of this thesis is to study cell-cell interactions and the development of an assay to explore and quantify the exchange of membrane compounds.
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appointed as full Professor of Artificial Intelligence and Medicinal Chemistry
Gerard van Westen has been appointed full Professor or Artificial Intelligence and Medicinal Chemistry. This chair has been jointly created by the Leiden Academic Centre for Drug Research (LACDR) and the Leiden Institute of Chemistry (LIC) as part of SAILS, the university stimulus program in Artificial…
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Chemical Similarity: Structuring Risk and Hazard Assessment
At the moment, over 350.000 chemicals are registered worldwide for production and use. Their application, however, may harm human health and the environment.
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University strengthens its focus on Chemical Biology and Medicinal Chemistry with seven new group leaders
Tackling key challenges of Chemical Biology and Medicinal Chemistry to aid drug discovery is one of the focus areas of Leiden University. To this end, the Leiden Early Drug Discovery & Development network (LED3) was established by the Leiden Institute of Chemistry (LIC), the Institute of Biology Leiden…
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Dirk Bouwmeester
Science
bouwmeester@physics.leidenuniv.nl | +31 71 527 5892
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Surendra Balraadjsing
Science
s.balraadjsing@cml.leidenuniv.nl | +31 71 527 2727
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Former Chemistry PhD student Tiddo Mooibroek nominated for New Scientist Talent prize
Former Chemistry PhD student Tiddo Mooibroek is one of the 25 nominees for the title New Scientist Science Talent 2017. Nobel prize winner Ben Feringa will announce the winner at the New Scientist Live: Nobelprijs event on June 22, after a rating of the candidates by a jury and a public vote.
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From chemistry teacher to founder of outdoor escape room company
Alumnus Vincent Renken studied Bio-Pharmaceutical Sciences in Leiden and is now co-founder of an outdoor escape room company. ‘I asked myself: do you want a standard life or an adventure?’
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Leiden University hosts world championship computer chess
At the annual World Computer Chess Championship, chess computers from all over the world compete with each other. This year, Leiden University hosted the event.
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Translation Beauty and Joy of Computing may convince girls to choose computer science
Programming courses are often only available in English. All the more reason for the Programming Education Research Lab (PERL) of the Leiden Institute of Advanced Computer Science (LIACS), Eindhoven University of Technology and University of Twente to translate the 'Beauty and Joy of Computing' programming…
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New in Leiden: Computer science and economics
In a survey held last year by the publication Elsevier, Leiden's Computer Science programme was voted by students as the best university programme of its kind in the Netherlands. And the Rotterdam Economics programme was voted the best in its field. Leiden University now offers a combined study based…
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Distinguished Member of the ACM for outstanding contributions to computing
On November 8, the Association for Computing Machinery (ACM) named Wessel Kraaij as one of the 2017 Distinguished Members. ACM Distinguished Members have made a significant contribution to the field of computing, computer science or information technology. This year, worldwide 43 scientists received…
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Smart chemistry rids anti-cancer drugs of serious side effects
Researchers of the Leiden University Medical Centre (LUMC) and the Leiden Institute of Chemistry have made an important discovery about the commonly used anti-cancer drug doxorubicin. They have found a way to reduce its side effects without sacrificing the effectiveness of the medication. This is encouraging…
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Ewine van Dishoeck receives ERC Advanced Grant for research into the chemistry of new worlds
Leiden Professor of Molecular astrophysics Ewine van Dishoeck has been awarded an Advanced Grant by the European Research Council (ERC). She has been awarded 2.3 million euros in research funding for the MOLDISK programme. Within this programme, Van Dishoeck wants to connect chemistry and physics in…
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Consortium puts Quantum Computer in the cloud
The quantum computer is on its way, but is society ready for it? Quantum computers have a reputation of being difficult to grasp because of their complexity. This limits society’s ability to envision future applications creating a gap between society and quantum computers. A consortium of 14 knowledge…
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Reactivity of cobalt(II)-dichalcogenide complexes: correlation between redox conversion and ligand-field strength
The redox-conversion reaction of metal-disulfide and metal-thiolate complexes are important, as they may shed light on electron-transfer reactions that often occur in Nature.
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Medical Delta AI for Computational Life Sciences
The fact that scientists are increasingly better able to access molecular cell and tissue data also brings with it a new challenge: how can scientists find the information they need for research among the vast amount of data available?
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Spiking Neural P Systems
Promotor: J.N. Kok, Co-promotor: H.J. Hoogeboom
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In memoriam Harold V.J. Linnartz 1965 – 2023: Unlocking the Chemistry of the Heavens
With great sadness we share the news that Prof. Harold Linnartz passed away suddenly and unexpectedly on Sunday 31 December 2023. We are all in shock, and our thoughts are with his wife and children, other family, and friends. Harold was at the heart of our institute, as a researcher, as a supervisor,…
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Computers help wood anatomists with wood identification
The most commonly used method for the taxonomic identification of tree trunks is wood anatomy. The number of experts in this area is decreasing, and education to become an wood anatomists takes many years. With the help of technology computer scientists of the Leiden Institute of Advanced Computer Science…
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Michael Lew explores how computers can see
Learning how computers can process and describe images just like human beings do. It is one of the key elements of the research of Michael Lew, who sees Deep Learning as a promising way to achieve this goal. On the 1st of January 2021, he was appointed Professor of Deep Learning at the Leiden Institute…
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Breaking the witches' spell: towards steering the soil microbiome for volatile-mediated control of the root parasitic weed Striga
Striga hermonthica, commonly known as witchweed, infests major cereal crops in Sub-Saharan Africa causing severe yield losses and threatening the livelihood of millions of resource poor farmers.
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Making everything we know computer-readable
Data and information should be stored in a way that computers can understand, says Barend Mons, professor of Biosemantics at the Leiden University Medical Center and Chair of the High Level Expert Group for the European Open Science Cloud. We speak with him about FAIR data, knowlets and nanopublicat…
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University provides computer lessons for refugees
Computer skills are essential if you want to become part of Dutch society. Leiden University and Stichting Bestaanskracht, an organisation that helps the vulnerable, are therefore providing computer lessons for refugees who can use some extra digital help.