COSMO-CAMD: A framework for optimization-based computer-aided molecular design using COSMO-RS

• Molecular machine learning in chemical process design

  2026 Current Opinion in Chemical Engineering review Materials Science Machine Learning in Materials Science Open access

  5

  citations
• Fine-Tuning a Genetic Algorithm for CAMD: A Screening-Guided Warm Start

  2025 Journal of Chemical Information and Modeling article Engineering Process Optimization and Integration Open access

  0

  citations
• Molecular Design of Fuels for Maximum Spark-Ignition Engine Efficiency by Combining Predictive Thermodynamics and Machine Learning

  2023 Energy & Fuels article Chemical Engineering Advanced Combustion Engine Technologies Open access

  25

  citations
• From Molecules to Heat‐Integrated Processes: Computer‐Aided Design of Solvents and Processes Using Quantum Chemistry

  2022 Chemie Ingenieur Technik article Engineering Process Optimization and Integration Open access

  5

  citations
• COSMO‐CAMPED – Solvent Design for an Extraction Distillation Considering Molecular, Process, Equipment, and Economic Optimization

  2022 Chemie Ingenieur Technik article Engineering Process Optimization and Integration Open access

  11

  citations
• The Thermo‐Economic Potential of ORC‐Based Pumped‐Thermal Electricity Storage: Insights from the Integrated Design of Processes and Working Fluids

  2022 Energy Technology article Engineering Thermodynamic and Exergetic Analyses of Power and Cooling Systems Open access

  16

  citations
• CAT-COSMO-CAMPD: Integrated in silico design of catalysts and processes based on quantum chemistry

  2021 Computers & Chemical Engineering article Environmental Science Chemistry and Chemical Engineering Open access

  11

  citations
• Rx‐COSMO‐CAMPD: Enhancing Reactions by Integrated Computer‐Aided Design of Solvents and Processes based on Quantum Chemistry

  2020 Chemie Ingenieur Technik article Engineering Process Optimization and Integration Open access

  19

  citations
• Towards optimal mixtures of working fluids: Integrated design of processes and mixtures for Organic Rankine Cycles

  2020 Renewable and Sustainable Energy Reviews article Engineering Thermodynamic and Exergetic Analyses of Power and Cooling Systems Open access

  49

  citations
• Computer-aided molecular and processes design based on quantum chemistry: current status and future prospects

  2020 Current Opinion in Chemical Engineering review Physics and Astronomy Advanced Chemical Physics Studies Open access

  76

  citations

10 results