Вкратце о том что это было такое:
А также список докладчиков, более или менее детальный:Winterschool on Computational Chemistry
It is a great tradition to share information among scientists. Since we strongly believe in this principle, we would like to start a new initiative, as a satellite from the bigger event 'Virtual conference computational chemistry VCCC'.
With the internet as basic tool, sharing information is today easier than ever. Already in the 90’s, Steven Bachrach had the idea of running a virtual computational chemistry conference (ECCC, electronic conference on computational chemistry) and Henry Rzepa followed it up with ECTOC (electronic conference on trends in organic chemistry, all four of which are still online at http://www.ch.ic.ac.uk/ectoc/). These were pretty much the first attempts ever made to share information among (computational and theoretical) chemists using media apart from regular conferences.
This ‘Winterschool Computational Chemistry’ organizes virtual lectures for young scientists (PhD/post-doc). Rather than discussing cutting edge research, our aim is more educational and we will provide theoretical background presented by our excellent speakers (see confirmed speakers).
Ну и конечно темы лекций (названия кликабельные, и ведут на .pdf или .webm )
- Julianna Oláh, Budapest University, Hungary
- F. Matthias Bickelhaupt, VU University Amsterdam, Radboud University Nijmegen, Netherlands
- Célia Fonseca Guerra, VU University Amsterdam, Netherlands
- Paul Geerlings, Free University Brussels, Belgium
- Henry Rzepa, Imperial college London, UK
- Stefan Grimme, Mulliken Center for Theoretical Chemistry, University of Bonn, Germany
- Miquel Solà, Universitat de Girona, Spain
- Peter A. Politzer, Cleve Theo Comp, USA
- Jane S. Murray, Cleve Theo Comp, USA
- Ajit J. Thakkar, University of New Brunswick Fredericton, Canada
- Andreas Savin, UPMC Sorbonne Universités, France
- Gernot Frenking, Fachbereich Chemie, Germany
- Jan H. Jensen, University of Copenhagen, Denmark
- Jeremy Harvey, University of Leuven, Belgium
- Filipp Furche, University of california, USA
- F. M. Bickelhaupt: "Predictive Catalysis Based on the Activation Strain Model and Quantitative MO Theory" (pdf)
- C. Fonseca Guerra: "Structure and Stability of B-DNA and G-DNA. Exploration and Insight from Kohn-Sham MO Theory" (pdf)
- G. Frenking: "Two investigations on triple bonds." (pdf)
- P. Geerlings: "Chemistry from the Linear Response Function" (pdf)
- J. S. Murray and P. Politzer: "A Physical Interpretation of Noncovalent Interactions" (pdf)
)- J. Harvey: "Understanding Chemical Reaction Mechanisms with Quantum Chemistry" (pdf)
- Jan H. Jensen "Quantum Biochemistry: The rise of semi-empirical methods and automation in quantum chemistry" (YouTube, slideshare)
- J. Oláh: "How to study the reactivity of enzymes? - Practical aspects of QM/MM calculations" (webm)
- S. Grimme and A. Hansen "Quantum Chemistry for Non-covalent Interactions" (pdf1, pdf2, pdf3, pdf4, pdf5)
upd. К сожалению onedrive не позволит посмотреть видео в потоке (кроме Furche SI), придется качать, sry
upd2. Добавил еще 5 лекций Гримме, наслаждайтесь
