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Record W4387937021 · doi:10.1007/s10514-023-10136-2

Large language models for chemistry robotics

2023· article· en· W4387937021 on OpenAlex

Why this work is in the frame

A frame that forgets how it found something cannot be audited. These are the routes that admitted this work.

affAt least one author lists a Canadian institution in the pinned OpenAlex snapshot.
fundA Canadian funder is recorded on the work.

Bibliographic record

VenueAutonomous Robots · 2023
Typearticle
Languageen
FieldComputer Science
TopicAI-based Problem Solving and Planning
Canadian institutionsVector InstituteArtificial Intelligence in Medicine (Canada)University of WaterlooUniversity of Toronto
FundersNatural Sciences and Engineering Research Council of Canada
KeywordsComputer scienceRoboticsExecutableRobotTask (project management)Artificial intelligenceNatural languageWorkspaceHuman–computer interactionSoftware engineeringProgramming languageSystems engineering

Abstract

fetched live from OpenAlex

Abstract This paper proposes an approach to automate chemistry experiments using robots by translating natural language instructions into robot-executable plans, using large language models together with task and motion planning. Adding natural language interfaces to autonomous chemistry experiment systems lowers the barrier to using complicated robotics systems and increases utility for non-expert users, but translating natural language experiment descriptions from users into low-level robotics languages is nontrivial. Furthermore, while recent advances have used large language models to generate task plans, reliably executing those plans in the real world by an embodied agent remains challenging. To enable autonomous chemistry experiments and alleviate the workload of chemists, robots must interpret natural language commands, perceive the workspace, autonomously plan multi-step actions and motions, consider safety precautions, and interact with various laboratory equipment. Our approach, CLAIRify , combines automatic iterative prompting with program verification to ensure syntactically valid programs in a data-scarce domain-specific language that incorporates environmental constraints. The generated plan is executed through solving a constrained task and motion planning problem using PDDLStream solvers to prevent spillages of liquids as well as collisions in chemistry labs. We demonstrate the effectiveness of our approach in planning chemistry experiments, with plans successfully executed on a real robot using a repertoire of robot skills and lab tools. Specifically, we showcase the utility of our framework in pouring skills for various materials and two fundamental chemical experiments for materials synthesis: solubility and recrystallization. Further details about CLAIRify can be found at https://ac-rad.github.io/clairify/ .

Fetched live from OpenAlex and de-inverted. Abstracts are not stored in this database: the inverted indexes are 8.6 GB of the frame’s 9.3 GB of text, and the host has 13 GB free.

Full frame distilled prediction

Teacher imitation

Not calibrated prevalence, not ground truth. Human validation pending. Learned from the 10,348 direct Codex labels and 10,348 direct Gemma labels. Candidate is the union of thresholded teacher heads; consensus is their intersection. These outputs are machine_predicted_unvalidated and are not human labels or direct frontier model labels.

metaresearch head score (Codex)0.000
metaresearch head score (Gemma)0.000
Version: codex-gemma-dda1882f352aValidation status: machine_predicted_unvalidated
Candidate categoriesnone
Consensus categoriesnone
DomainCandidate signal: none · Consensus signal: none
Study designCandidate signal: Simulation or modeling · Consensus signal: Simulation or modeling
GenreCandidate signal: Methods · Consensus signal: none
Teacher disagreement score0.836
Threshold uncertainty score0.636

Codex and Gemma teacher scores by category

CategoryCodexGemma
Metaresearch0.0000.000
Meta-epidemiology (narrow)0.0000.000
Meta-epidemiology (broad)0.0000.000
Bibliometrics0.0000.000
Science and technology studies0.0000.000
Scholarly communication0.0000.000
Open science0.0010.000
Research integrity0.0000.000
Insufficient payload (model declined to judge)0.0000.000

Machine scores (provisional)

The two teacher heads of the student model, read on this work. A score orders the frame for review; it never asserts a category, and the validation status ships verbatim with every row.

Baseline scores from an immature model (maturity gate not passed, 7 training rounds). Scores rank; they never assert a category.

Opus teacher head0.022
GPT teacher head0.262
Teacher spread0.240 · how far apart the two teachers sit on this one work
Validation statusscore_only:v0-immature-baseline · verbatim from the scoring run: score_only means the number may rank works, and no category label ships from it