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The World Association of Theoretical and Computational Chemists (WATOC) is a scholarly association founded in 1982 "in order to encourage the development and application of theoretical methods" in
chemistry Chemistry is the scientific study of the properties and behavior of matter. It is a physical science within the natural sciences that studies the chemical elements that make up matter and chemical compound, compounds made of atoms, molecules a ...
, particularly
theoretical chemistry Theoretical chemistry is the branch of chemistry which develops theoretical generalizations that are part of the theoretical arsenal of modern chemistry: for example, the concepts of chemical bonding, chemical reaction, valence, the surface ...
and
computational chemistry Computational chemistry is a branch of chemistry that uses computer simulations to assist in solving chemical problems. It uses methods of theoretical chemistry incorporated into computer programs to calculate the structures and properties of mol ...
. It was originally called the World Association of Theoretical Organic Chemists, but was later renamed the World Association of Theoretically Oriented Chemists, and in 2005 renamed once more to the World Association of Theoretical and Computational Chemists.


Conferences

WATOC organizes a triennial world congress with over 1,000 participants in last years.


Awards

The association awards two yearly medals: the Schrödinger Medal to one "outstanding
theoretical A theory is a systematic and rational form of abstract thinking about a phenomenon, or the conclusions derived from such thinking. It involves contemplative and logical reasoning, often supported by processes such as observation, experimentation, ...
and
computational A computation is any type of arithmetic or non-arithmetic calculation that is well-defined. Common examples of computation are mathematical equation solving and the execution of computer algorithms. Mechanical or electronic devices (or, historic ...
chemist", and the Dirac Medal to one "outstanding theoretical and computational chemist under the age of 40".


Recipients of the Dirac Medal

Source
WATOC
* 1998: Timothy J. Lee * 1999: Peter M. W. Gill * 2000: Jiali Gao * 2001: Martin Kaupp * 2002: Jerzy Cioslowski * 2003: Peter Schreiner * 2004: Jan Martin * 2005: Ursula Röthlisberger * 2006: Lucas Visscher * 2007:
Anna Krylov Anna Igorevna Krylov (Russian: Анна Игоревна Крылова) is the USC Associates Chair in Natural Sciences and Professor of Chemistry at the University of Southern California (USC). Working in the field of theoretical and computati ...
* 2008:
Kenneth Ruud Kenneth Ruud (born 16 September 1969) is a Norwegian chemist. He is a professor of chemistry at the University of Tromsø. He is author or coauthor of more than 150 scientific articles and director of the Centre for Theoretical and Computational ...
* 2009: Jeremy Harvey * 2010: Daniel Crawford * 2011:
Leticia González Leticia González Herrero (born in Madrid) is a theoretical chemist, known for her work on molecular excited states, especially ultrafast dynamics of DNA nucleobases and highly accurate simulations of transition metal complexes. Biography Leticia ...
* 2012:
Paul Ayers Paul Nicholas Ayers (b September 1961) has been Archdeacon of Leeds since 2017. Ayers has a family with 4 children and 12 grandchildren, his favourite of which is his first grandchild Lydia. Ayers was educated at St Peter's College, Oxford and ...
* 2013: Filipp Furche * 2014: Denis Jacquemin * 2015: Edward Valeev * 2016: Johannes Neugebauer * 2017: Francesco Evangelista * 2018:
Erin Johnson Erin Johnson is a Canadian computational chemist. She holds the Herzberg–Becke Chair at Dalhousie University. She works on density functional theory and intermolecular interactions. Education and early career Johnson is from Ottawa, Canada. ...
* 2019:
Satoshi Maeda is a generally masculine Japanese given name. Written forms *, "intelligent, philosophy, clear" *, "bodhi, enlightenment, apprehension" *, "quick, sharp" *, "knowledge, wisdom" *, "intelligent, clever, bright" *, "bright, intelligent" *, "te ...
* 2020: Alexandre Tkatchenko * 2021: Edit Matyus * 2022: Katharina Boguslawski * 2023: Thomas Jagau * 2024: Alexander Sokolov


List of presidents

Presidents of WATOC:


External links


WATOC home page


References

For instance, in 2005 it was called "World Association of Theoretically Oriented Chemists" as can be seen in the poster for WATOC-2005 congress: {{Authority control Chemistry societies Scientific organizations established in 1982