Syntax-guided optimal synthesis for chemical reaction networks

We study the problem of optimal syntax-guided synthesis of stochastic Chemical Reaction Networks (CRNs) that plays a fundamental role in design automation of molecular devices and in the construction of predictive biochemical models. We propose a sketching language for CRNs that concisely captures s...

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Main Authors: Cardelli, L, Ceska, M, Fraenzle, M, Kwiatkowska, M, Laurenti, L, Paoletti, N, Whitby, M
Format: Conference item
Published: Springer 2017
Subjects:
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author Cardelli, L
Ceska, M
Fraenzle, M
Kwiatkowska, M
Laurenti, L
Paoletti, N
Whitby, M
author_facet Cardelli, L
Ceska, M
Fraenzle, M
Kwiatkowska, M
Laurenti, L
Paoletti, N
Whitby, M
author_sort Cardelli, L
collection OXFORD
description We study the problem of optimal syntax-guided synthesis of stochastic Chemical Reaction Networks (CRNs) that plays a fundamental role in design automation of molecular devices and in the construction of predictive biochemical models. We propose a sketching language for CRNs that concisely captures syntactic constraints on the network topology and allows its under-specification. Given a sketch, a correctness specification, and a cost function defined over the CRN syntax, our goal is to find a CRN that simultaneously meets the constraints, satisfies the specification and minimizes the cost function. To ensure computational feasibility of the synthesis process, we employ the Linear Noise Approximation allowing us to encode the synthesis problem as a satisfiability modulo theories problem over a set of parametric Ordinary Differential Equations (ODEs). We design and implement a novel algorithm for the optimal synthesis of CRNs that employs almost complete refutation procedure for SMT over reals and ODEs, and exploits a meta-sketching abstraction controlling the search strategy. Through relevant case studies we demonstrate that our approach significantly improves the capability of existing methods for synthesis of biochemical systems and paves the way towards their automated and provably-correct design.
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spelling oxford-uuid:d44a5077-8c66-487b-a67b-28ec5151947f2022-03-27T08:17:27ZSyntax-guided optimal synthesis for chemical reaction networksConference itemhttp://purl.org/coar/resource_type/c_5794uuid:d44a5077-8c66-487b-a67b-28ec5151947f*subject*Symplectic Elements at OxfordSpringer2017Cardelli, LCeska, MFraenzle, MKwiatkowska, MLaurenti, LPaoletti, NWhitby, MWe study the problem of optimal syntax-guided synthesis of stochastic Chemical Reaction Networks (CRNs) that plays a fundamental role in design automation of molecular devices and in the construction of predictive biochemical models. We propose a sketching language for CRNs that concisely captures syntactic constraints on the network topology and allows its under-specification. Given a sketch, a correctness specification, and a cost function defined over the CRN syntax, our goal is to find a CRN that simultaneously meets the constraints, satisfies the specification and minimizes the cost function. To ensure computational feasibility of the synthesis process, we employ the Linear Noise Approximation allowing us to encode the synthesis problem as a satisfiability modulo theories problem over a set of parametric Ordinary Differential Equations (ODEs). We design and implement a novel algorithm for the optimal synthesis of CRNs that employs almost complete refutation procedure for SMT over reals and ODEs, and exploits a meta-sketching abstraction controlling the search strategy. Through relevant case studies we demonstrate that our approach significantly improves the capability of existing methods for synthesis of biochemical systems and paves the way towards their automated and provably-correct design.
spellingShingle *subject*
Cardelli, L
Ceska, M
Fraenzle, M
Kwiatkowska, M
Laurenti, L
Paoletti, N
Whitby, M
Syntax-guided optimal synthesis for chemical reaction networks
title Syntax-guided optimal synthesis for chemical reaction networks
title_full Syntax-guided optimal synthesis for chemical reaction networks
title_fullStr Syntax-guided optimal synthesis for chemical reaction networks
title_full_unstemmed Syntax-guided optimal synthesis for chemical reaction networks
title_short Syntax-guided optimal synthesis for chemical reaction networks
title_sort syntax guided optimal synthesis for chemical reaction networks
topic *subject*
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AT ceskam syntaxguidedoptimalsynthesisforchemicalreactionnetworks
AT fraenzlem syntaxguidedoptimalsynthesisforchemicalreactionnetworks
AT kwiatkowskam syntaxguidedoptimalsynthesisforchemicalreactionnetworks
AT laurentil syntaxguidedoptimalsynthesisforchemicalreactionnetworks
AT paolettin syntaxguidedoptimalsynthesisforchemicalreactionnetworks
AT whitbym syntaxguidedoptimalsynthesisforchemicalreactionnetworks