- PhysChem & ADME-Tox Prediction
- ACD/Percepta
- Profilers
- Predictors
- Structure Design
- Batch Modules
- ACD/I-Lab
PhysChem and ADME-Tox Prediction
Clearly the industry standard PhysChem prediction models, and deserve the position. They are the most consistent predictions that are applicable and usable in more complex models of drug-likeness.
Computational Chemist
ACD/Labs' physicochemical and ADMET prediction software provides…a surprising wealth of information on
compound drug-likeness in a simple to use, intuitive format with excellent output graphics.
Bill Simmons, Layola University
The ACD/Labs suite is a core component of our drug discovery toolkit and has much value for us.
Medical Research Council Technologies, UK
The big advantage of your software is the big 'Easy Button' for all predictions, where you just drop in a
structure and hit go, then everything you want is right there.
Brian Dean, Genetech
The best in silico toxicity software I have used. It was very easy to use, and a lot of information could be obtained.
Tim Tam, Apotex Pharma
It's nice to have PhysChem, ADME, Tox in one sleek interface, that’s very user friendly.
Regis Leung-Toung, Apotex Pharma
For almost two decades ACD/Labs has delivered value to scientists all over the world through solutions that help them predict and understand the behaviour of their compounds; through examination of structure-property relationships from structure.
The new ACD/Percepta platform delivers our full complement of PhysChem; Absorption, Distribution, Metabolism, and Excretion (ADME); and toxicity prediction tools in one seamless environment. It offers three product lines to help investigate physicochemical properties, ADME characteristics, and toxicity endpoints, along with a number of options, from desktop installations or thin client access, to web services and API that make it easy to deploy our predictors to small groups, departments, or the entire organization.
Predictors—in-depth study of structure-property relationships
Profilers—quick insights with comprehensive property profiles
ACD/Structure Design Engine—property-based optimization for synthetic chemists
The majority of prediction modules offer model training with experimental data, to customize prediction accuracy to proprietary chemical space.
Batch Predictors
For those that work with large numbers of compounds in screening, populating corporate databases, using predicted values as descriptors for in-house predictive models, or utilizing our prediction algorithms in your data mining tools/workflows (such as Pipeline Pilot); our Linux-based Batch applications offer the ability to process tens of thousands of compounds in minutes with limited human intervention.
Predictors for Intranets
As an alternative to Batch predictors, implement our ACD/I-Lab for Intranets API to provide our predictions and structure-enabled databases to multiple users over your custom intranet interface. All you need are simple internet connections, protected by your own security systems and firewalls, for easy broad deployment.
With continued excellence in prediction, a broad range of tools and applications, flexible licensing, and a variety of deployment options, we are confident that we can provide a solution to meet your needs.
