MUG '03 -- 25 - 28 Feb, 2003

Daylight Property Package

John Bradshaw
Daylight CIS


The calculation of molecular properties from structure has always been closely associated with the Daylight and its progenitors. For many, the calculation of CLOGP was their first introduction to our software. With the advent of virtual screening there has been a resurgence in the requirements for rapid estimation of appropriate properties directly from structure. To that end, Daylight are introducing a Property Package which will provide values for most of the commonly used properties. The architecture of the package allows for additional properties to be added should they be required. Use of the program object technology ensures that the same code ( and hence the same answers ) are accessible from many programs including DayCart™

Presentation slides:

Daylight Chemical Information Systems, Inc.