Research

Building the instruments

Two tracks, one habit: build the thing that measures before trusting what it measures.

Agents

Agent Infrastructure

I build reproducible agent evaluation environments and test whether benchmark scores are supported by the underlying evidence. My work includes controlled skill evaluations, runtime evidence integrity, and scientific task validation.

  • SkillsBench

    Accepted to NeurIPS 2026 Evaluations and Datasets Track · Poster

    Benchmarking how well agent skills work across diverse tasks.

    • Built the agent sandbox across 18 model–harness configurations, with per-trial container isolation, raw trajectories, usage accounting, and pass/fail evidence.
    • Designed paired evaluations across 87 tasks with task-macro pass rates and 95% CIs; curated Skills raised pass rates from 33.9% to 50.5% (+16.6 pp).
  • ClawsBench

    COLM 2026

    Evaluating capability and safety of LLM productivity agents in simulated workspaces.

    • Simulates five productivity services — Gmail, Slack, Google Calendar, Google Docs, Google Drive — as one coherent workspace.
    • 44 tasks that test capability and safety together, rather than treating safety as a separate afterthought benchmark.
  • BenchShield

    arXiv:2609.11028 · under review

    Formal model-backed instrumentation for reward integrity in LLM-agent evaluation infrastructure.

    • Hardened runtime evidence checks against tampered event annotations and unsupported verdicts; added regression tests for missing evidence and action attribution.
    • Built a resumable annotation runner that validates completion from generated artifacts and records token usage and cost for each model call.
  • ScienceIDE

    AItonomy Foundation · arXiv:2609.19134

    Turning World’s Scientific Codebase into Agent Learnable Environments.

    • Packaged Scirpy (single-cell immune-receptor repertoire analysis) as the bioinformatics environment in a 64-environment registry of executable scientific-code tasks, with acceptance criteria that check scientific outputs, not just successful execution.
  • BenchFlow eval infrastructure

    BenchFlow · 2026

    The evaluation environment and runtime powering benchmark suites — SkillsBench, ClawsBench, AgentFuzzBench.

  • FDA review agent & FDABench

    Deffai · 2026

    A full-stack review agent for FDA submissions — RAG over regulations and guidance, a multi-step review workflow with citation provenance — and FDABench, the end-to-end evaluation that scores its outputs against reference reviews.

  • Agent Skills '26

    ACM CAIS 2026 · Workshop organizer

    Co-organizer of the first workshop on the design, evaluation, and optimization of procedural knowledge for LLM agents.

Biomedical

Biomedical AI

Single-cell and spatial assays produce far more data than anyone can interpret by hand. I build models that turn those matrices into biology: cell-type annotation, tumour microenvironment structure, and drug–disease relationships read off a knowledge graph.

  • DG-scRNA

    ICIBM 2025 · Oral presentation · Conference abstract

    A graph-convolutional network with cluster visualization that predicts cell types from single-cell RNA-seq — 97.2% accuracy across more than 150,000 cells. First-author manuscript.

  • Thyroid tumour microenvironment

    The Ohio State University · in progress

    Integrated scRNA-seq with spatial transcriptomics across 25 thyroid cancer samples; identified 50+ ligand–receptor interactions and two previously undescribed cell subtypes.

  • DeepDR

    arXiv:2511.08921 · 2025

    A drug-repositioning web server: 15+ deep learning models over a knowledge graph of 5.9M edges and 107 relationship types, with visualizations that explain why each drug is recommended rather than just ranking them.

  • CRISPR gRNA on-target prediction

    The Ohio State University

    Benchmarked CNN, RNN, and Transformer architectures over 50,000+ curated guide sequences to establish which inductive bias the problem actually rewards.

  • O-GlcNAc and genotoxic stress

    Nature Communications · 2020

    Earlier wet-lab and computational work: proteomic profiling and genome-wide ChIP-seq mapping of O-GlcNAc chromatin-associated proteins, which uncovered an O-GlcNAc-regulated genotoxic stress response.

Elsewhere

Elsewhere

yiminliu.career at gmail.com