Advanced Chemistry Development.Developments in Physicochemical & Spectral Prediction and Databasing Tools.Synopsys Users Meeting September 1998.

04.10.98


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Table of Contents

Advanced Chemistry Development
Developments in Physicochemical & Spectral Prediction and Databasing Tools.
Synopsys Users Meeting September 1998.

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NMR Prediction Software

H1/C13/F19/P31 NMR Spectral Prediction

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NMR Processor and Management

...fully integrated with ACD/NMR Manager

MS Manager Module : ACD/SpecManager

...with Processing and Assignment Toolset

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...with full spectral processing toolkit

ACD/SpecManager SQL

IUPAC Naming and Index Naming Software

LogP Prediction - now User Fragments are used for training!!!

LogD Prediction Using LogP UserBase

LC Simulator - Based on LogP and LogD!!!

Combinatorial Support

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Access ACD from pulldown or...

ACD Run Button for Menu of Module Choices...

..for 3D Viewing...Module available for FREE for Isis/Draw and Isis/Base from www.acdlabs.com !!!

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...with dialog boxes for manipulation of predicted spectra

Isis/Base Connectivity made through ACD/Labs Link Manager

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Interactive Lab - ACD/ILab.www.acdlabs.com/ilab

Interactive Lab Gateway

Structure Drawing Applet

Client Server Ilab Architecture

ChemSketch On-line Integration

ChemSketch On-line Integration

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Future Developments

LC Manager First Shot...

Advanced Chemistry Development Partners and Collaborators

Free Stuff...www.acdlabs.com

Advanced Chemistry Development.Developments in Physicochemical & Spectral Prediction and Databasing Tools.Synopsys Users Meeting September 1998.

Author: Antony Williams

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