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FAHCustomNEQIntegrator #476

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FAHCustomNEQIntegrator #476

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@dominicrufa dominicrufa commented Jul 15, 2020

Description

subclass of PeriodicNonequilibriumIntegrator except equilibrium caching is used to maintain equilibrium MD at endstates

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  • Ready to go

@dominicrufa dominicrufa requested a review from jchodera July 15, 2020 20:23
@jchodera jchodera self-assigned this Mar 17, 2022
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@jchodera jchodera Awaiting requested review from jchodera

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⬆️ high-priority high-effort 🌠 enhancement

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@dominicrufa @jchodera @mikemhenry