Title of article :
QRC: a rapid method for connecting transition structures to reactants in the computational analysis of organic reactivity
Author/Authors :
Goodman، نويسنده , , Jonathan M and Silva، نويسنده , , Mar??a A، نويسنده ,
Issue Information :
هفته نامه با شماره پیاپی سال 2003
Abstract :
A new procedure, QRC calculation, is presented which provides useful information for analysing organic reactions and links transition structures to starting materials and products. QRC calculations are an alternative to computationally demanding IRC calculations, which find more information than is needed for this analysis.
Journal title :
Tetrahedron Letters
Journal title :
Tetrahedron Letters