ADME and Dermal Penetration

Ecotoxicology

Environmental fate

Genetic Toxicology

Field trials

Mammalian Toxicology

Metabolite Identification

Physical Chemical Properties

Plant and Livestock Metabolism

Regulatory Affairs

Residue Analysis

Synthesis

In vitro Techniques

Programme Management and Consultancy

 

Environmental modelling

The use of computer modelling to predict the behaviour of active substances and their metabolites in the environment, is a fundamental part of environmental risk assessment. Central to this, is the prediction of concentrations of an active substance or metabolite (PECs) that may occur in the different environmental compartments that are at risk.

There are different models and objectives for the different environmental compartments. For groundwater, surface water and sediments in Europe, FOCUS groups have created standardised scenarios that are between them, typical of much of European agriculture. Similarly, in the USA, the EPA recognises a number of models that may be used for exposure assessments.

Our expert modellers have extensive experience of using the following models:

  • MACRO, PEARL, PELMO AND PRZM models to calculate groundwater PECs, particularly in conjunction with FOCUS model scenarios in Europe
  • MACRO, PRZM, SWASH and TOXSWA to calculate surface water PECs, again particularly in conjunction with FOCUS model scenarios in Europe
  • The European MEDRICE model and the US models RICEWQ and RIVWQ to calculate PECs in the different environmental compartments associated with growing rice in paddy fields

We also have considerable experience in using higher tier modelling to refine risk assessments.

Assessment of the potential environmental exposure should be part of the process for selecting a candidate molecule for development. Having started development, environmental exposure should be reviewed whenever additional relevant input data becomes available.

Early stage modelling can be done quickly with very limited experimental data. We can offer comment on how variations in the proposed label use of the active substance (GAP) will affect the PECs. Our service is totally flexible. At any time in the development cycle, we can offer a range of services from modelling on its own through to a complete environmental risk assessment for submission to a regulatory authority.