API
Documentation for each of the classes contained within the openff.evaluator framework.
Client Side API
Exceptions
Server Side API
Physical Property API
Built-in Properties
Substance Definition
State Definition
Data Set API
NIST ThermoML Archive
Taproom
Data Set Curation
Filtering
FreeSolv
ThermoML
Data Point Selection
Data Conversion
Force Field API
Gradient Estimation
Calculation Layers API
Built-in Calculation Layers
Calculation Backends API
Dask Backends
Storage API
Built-in Storage Backends
Data Classes
Data Queries
Attributes
Workflow API
Schemas
Attributes
Placeholder Values
Built-in Workflow Protocols
Analysis
Coordinate Generation
Force Field Assignment
Gradients
Groups
Miscellaneous
OpenMM
Paprika
Reweighting
Simulation
Storage
YANK Free Energies
Workflow Construction Utilities
Attribute Utilities
Observable Utilities
Plug-in Utilities
Plug-ins