Chemistry enhanced podcasts, Imperial College London.

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Episodes

Date Title & Description Contributors
2012-02-21

  Molecular modelling, 2012, Lecture 7

Two case studies involving the principles of stereochemical design
  Henry Rzepa author
2012-02-20

  Conformational analysis, 2012, Lecture 5

Cyclo-octane, trans-cyclo-octene, and atripisomerism. Caroyophyllene and biphenyls.
  Henry Rzepa author
2012-02-20

  Molecular modelling, 2012, Lecture 6

Transition state modelling; reaction coordinates and aromatic electrophilic substitution. Pyridine, concerted vs Wheland intermediates. The Diels Alder reaction in a cavity.
  Henry Rzepa author
2012-02-15

  Molecular modelling, 2012, Lecture 5

The analysis of wave functions, including molecular orbitals, electrostatic potentials, QTAIM critical points, and the NCI method.
  Henry Rzepa author
2012-02-15

  Molecular modelling, 2012, Lecture 4

Overview of quantum mechanical methods, the Hamiltonian, the best set and extrapolative methods.
  Henry Rzepa author
2012-02-15

  Molecular modelling, 2012, Lecture 3

The mechanics force field, how it is used to optimize molecular geometries, and a case study.
  Henry Rzepa author
2012-02-15

  Molecular modelling, 2012, Lecture2

The techniques of molecular visualisation, and the sources of coordinates.
  Henry Rzepa author
2012-02-09

  Conformational analysis, 2012, Lecture 4.

Conformational analysis of 3,4,5 and 6-membered rings.
  Henry Rzepa author
2012-02-07

  Molecular modelling, 2012, lecture 1

General aspects of molecular modelling, including scales, coordinates, properties and reactivity.
  Henry Rzepa author
2012-02-06

  Conformational analysis, 2012, Lecture 3.

The conformational preferences of alikeness, aldehydes, ketones, esters and amides.
  Henry Rzepa author