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As one of the extensible points (#499) in gufe, we should include a how-to doc on how to define entirely new Protocols. This should highlight:
gufe
ProtocolResult
ProtocolUnit
Protocol.create()
ProtocolDAG
Component
openmm
openff
rdkit
This should reference the corresponding concept doc on Protocols, which covers what Protocols do and how they are structured.
The text was updated successfully, but these errors were encountered:
dotsdl
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As one of the extensible points (#499) in
gufe
, we should include a how-to doc on how to define entirely newProtocol
s. This should highlight:Protocol
andProtocolResult
ProtocolUnit
subclassesProtocol.create()
to yield aProtocolDAG
that is parallelizableComponent
s that are useful forProtocol
s, such as methods for going to and fromopenmm
,openff
, andrdkit
objectsThis should reference the corresponding concept doc on
Protocol
s, which covers whatProtocol
s do and how they are structured.The text was updated successfully, but these errors were encountered: