This book is a practical, easy to use guide for readers with limited experience of molecular modelling. It will provide students at the undergraduate and early postgraduate chemistry level with a similar entry to modelling. The needs of independent readers are catered for by the inclusion of instructions for acquiring and setting up a suitable computer. To further the aims of the book, compact discs are included that provide a comprehensive suite of modelling software and datasets. For further information see http://www.rsc.org/shop/books/2011/9781849733526.asp
Computational chemistry demystified
25 Nov 2011