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Biochemical Engineering Lab

Biochemical Engineering Lab

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Professor

About

KAIST 생명화학공학과 김지한(Jihan Kim) 교수의 분자 모사 연구실(Molecular Simulation Group)이다. 양자·고전 시뮬레이션과 고성능 컴퓨팅, 인공지능(대규모 언어모델 포함)을 활용해 탄소 포집, 기체 저장·분리, 배터리 등 에너지·환경 응용에 최적화된 금속유기골격체(MOF) 등 나노소재를 설계한다.

Research keywords

Molecular SimulationHigh-performance ComputingMetal-organic Frameworks (MOF)Carbon CaptureGas Storage/SeparationAI for Materials

Recent papers

From OpenAlex · papers whose author affiliation matches this university

Selected publications

  • Large Language Models for Porous Materials: From Text Mining to Autonomous LaboratoryDigital Discovery · 2026
  • LLMB: AI Agent for Lithium Metal Battery Research Using Large Language ModelACS Central Science · 2026
  • Accelerating CO2 Direct Air Capture Screening for Metal-Organic Frameworks with a Transferable Machine Learning Force FieldMatter · 2025
  • Harnessing Large Language Model to Collect and Analyze Metal-Organic Framework Property Data SetJACS · 2025
  • From Data to Discovery: Recent Trends of Machine Learning in Metal-Organic FrameworksJACS Au · 2024

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