Machine_Learning_in_Chemistry_The_Impact_of_Artificial_Intelligence.pdf
90.8 MB
Machine Learning in Chemistry _ The Impact of Artificial Intelligence by Hugh M. Cartwright
FZJ-2014-02193.pdf
270.8 KB
Introduction to Molecular Dynamics Simulation
Biophysical_chemistry_by_Alan_Cooper,_Royal_Society_Of_Chemistry.pdf
19.1 MB
Biophysical chemistry by Alan Cooper, Royal Society Of Chemistry
Experimental Confirmation of the Fundamental Principle of Wave-Particle Duality
https://scitechdaily.com/experimental-confirmation-of-the-fundamental-principle-of-wave-particle-duality/
https://scitechdaily.com/experimental-confirmation-of-the-fundamental-principle-of-wave-particle-duality/
SciTechDaily
Experimental Confirmation of the Fundamental Principle of Wave-Particle Duality
Complementarity relation of wave-particle duality is analyzed quantitatively with entangled photons as path detectors. The twenty-first century has undoubtedly been the era of quantum science. Quantum mechanics was born in the early twentieth century and…
Anchoring single atoms for catalysis
https://phys.org/news/2021-08-anchoring-atoms-catalysis.html
https://phys.org/news/2021-08-anchoring-atoms-catalysis.html
phys.org
Anchoring single atoms for catalysis
There is a dictum to "never change a running system." New methods can however be far superior to older ones. While to date chemical reactions are mainly accelerated by catalytic materials that comprise ...
A reaction that removes sulfur, nitrogen or oxygen atoms from six-membered rings using only blue light
https://phys.org/news/2021-08-reaction-sulfur-nitrogen-oxygen-atoms.html
https://phys.org/news/2021-08-reaction-sulfur-nitrogen-oxygen-atoms.html
phys.org
A reaction that removes sulfur, nitrogen or oxygen atoms from six-membered rings using only blue light
A team of chemists at the University of California, Berkeley, working with a group at Merck & Co. Inc. has developed a reaction that can be used to remove a single sulfur, nitrogen or oxygen atom from ...
Happy Birthday, Ernest Rutherford | Newsroom
https://www.newsroom.co.nz/ideasroom/happy-birthday-ernest-rutherford
https://www.newsroom.co.nz/ideasroom/happy-birthday-ernest-rutherford
Newsroom
Happy birthday, Ernest Rutherford
It’s the 150th anniversary of the birth of New Zealand’s most celebrated scientist, Ernest Rutherford. Richard Easther acknowledges the man who brought us the insight that our world is made of atoms. If there is an afterlife for physicists it will certainly…
AlphaFold the Google AI for prediction of protein folding is now integrated in ChimeraX!!!
https://twitter.com/UCSFChimeraX/status/1433322119438368772
https://twitter.com/UCSFChimeraX/status/1433322119438368772
Twitter
ChimeraX
Run AlphaFold structure prediction from ChimeraX. youtu.be/le7NatFo8vI
And if you don't know what AlphaFold is yet: https://www.nature.com/articles/d41586-021-02265-4
Nature
Protein-structure prediction revolutionized
Nature - Accurate predictions of the structures of almost all human proteins.
Putting a new theory of many-particle quantum systems to the test
https://phys.org/news/2021-09-theory-many-particle-quantum.html
https://phys.org/news/2021-09-theory-many-particle-quantum.html
phys.org
Putting a new theory of many-particle quantum systems to the test
New experiments using trapped one-dimensional gases—atoms cooled to the coldest temperatures in the universe and confined so that they can only move in a line—fit with the predictions of the recently ...
We cordially invite you to our "International Symposium on Correlated Electrons (SymCorrel21)" to be held online during 5-7 October 2021:
https://www.mcqst.de/news-and-events/symcorrel21/
This international and interdisciplinary symposium shall bring together experts from the different subfields of the quantum sciences to elaborate on systematic theoretical and computational approaches to interacting many-electron quantum systems in quantum many-body physics, particular quantum chemistry.
We hope very much that we can welcome many of you as active participants, making this a particularly inspiring event.
Yours sincerely,
David Mazziotti and Christian Schilling
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Symposium on Correlated Electrons (SymCorrel21)
Organizers: David Mazziotti and Christian Schilling
https://www.mcqst.de/news-and-events/symcorrel21/
E-mail: symcorrel21[]mcqst.de
https://www.mcqst.de/news-and-events/symcorrel21/
This international and interdisciplinary symposium shall bring together experts from the different subfields of the quantum sciences to elaborate on systematic theoretical and computational approaches to interacting many-electron quantum systems in quantum many-body physics, particular quantum chemistry.
We hope very much that we can welcome many of you as active participants, making this a particularly inspiring event.
Yours sincerely,
David Mazziotti and Christian Schilling
---------------------------------------------------
Symposium on Correlated Electrons (SymCorrel21)
Organizers: David Mazziotti and Christian Schilling
https://www.mcqst.de/news-and-events/symcorrel21/
E-mail: symcorrel21[]mcqst.de
International Symposium on Correlated Electrons | SymCorrel21
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Researchers reveal a novel metal where electrons flow with fluid-like dynamics
https://phys.org/news/2021-09-reveal-metal-electrons-fluid-like-dynamics.html
https://phys.org/news/2021-09-reveal-metal-electrons-fluid-like-dynamics.html
phys.org
Researchers reveal a novel metal where electrons flow with fluid-like dynamics
A team of researchers from Boston College has created a new metallic specimen where the motion of electrons flows in the same way water flows in a pipe—fundamentally changing from particle-like to fluid-like ...
Ig Nobel for chemists who analysed the smell of cinema audiences | News | Chemistry World
https://www.chemistryworld.com/news/ig-nobel-for-chemists-who-analysed-the-smell-of-cinema-audiences/4014384.article
https://www.chemistryworld.com/news/ig-nobel-for-chemists-who-analysed-the-smell-of-cinema-audiences/4014384.article
Chemistry World
Ig Nobel for chemists who analysed the smell of cinema audiences
Meowsic, nose-unblocking orgasms and colliding pedestrians among other research topics recognised in annual award ceremony
Real space electron delocalization, resonance, and aromaticity in chemistry | Nature Communications
https://www.nature.com/articles/s41467-021-25091-8
https://www.nature.com/articles/s41467-021-25091-8
Nature
Real space electron delocalization, resonance, and aromaticity in chemistry
Nature Communications - The concept of delocalization, resonance and aromaticity are commonly discussed within electronic structure frameworks relying on specific wave function expansions. Here the...