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  1. dynsight : An open Python platform for simulation and experimental trajectory data analysis

    Article • The Journal of Chemical Physics, February 2026, American Institute of Physics

    Dr Andrew Tarzia

  2. Adjacent backbone interactions control self-sorting of chiral heteroleptic Pd3A2B4 isosceles triangles and Pd4A4C4 pseudo-tetrahedra

    Article • Chem, February 2026, Elsevier

    Dr Andrew Tarzia

  3. The role of shape and interaction directionality on the crystalline phase behaviour of octahedral metal organic cages

    Article • September 2025, American Chemical Society (ACS)

    Dr Andrew Tarzia

  4. A Combined Experimental and Computational Exploration of Heteroleptic cis ‐Pd 2 L 2 L’ ...

    Article • Chemistry - A European Journal, November 2024, Wiley

    Dr Andrew Tarzia

  5. Diastereoselective Self‐Assembly of Low‐Symmetry PdnL2n Nanocages through Coordination‐Sphere Engineering**

    Article • Angewandte Chemie, November 2023, Wiley

    Dr Andrew Tarzia

  6. Diastereoselective Self‐Assembly of Low‐Symmetry Pd n L 2 n ...

    Article • Angewandte Chemie, November 2023, Wiley

    Dr Andrew Tarzia

  7. Solution-processable polytriazoles from spirocyclic monomers for membrane-based hydrocarbon separations

    Article • Nature Materials, October 2023, Springer Science + Business Media

    Dr Andrew Tarzia

  8. Systematic exploration of accessible topologies of cage molecules via minimalistic models

    Article • August 2023, American Chemical Society (ACS)

    Dr Andrew Tarzia

  9. Tetramine Aspect Ratio and Flexibility Determine Framework Symmetry for Zn8L6 Self‐Assembled Structures

    Article • Angewandte Chemie, February 2023, Wiley

    Dr Andrew Tarzia

  10. Tetramine Aspect Ratio and Flexibility Determine Framework Symmetry for Zn8L6 Self‐Assembled Structures

    Article • Angewandte Chemie, February 2023, Wiley

    Dr Andrew Tarzia

  11. Pore topology analysis in porous molecular systems

    Article • Royal Society Open Science, February 2023, Royal Society Publishing

    Dr Andrew Tarzia

  12. Toy models map possible cage structures

    Article • Chemical Science, January 2023, Royal Society of Chemistry

    Dr Andrew Tarzia

  13. Competitive aminal formation during the synthesis of a highly soluble, isopropyl-decorated imine porous organic cage

    Article • Chemical Communications, January 2023, Royal Society of Chemistry

    Dr Andrew Tarzia

  14. The effect of disorder in multi-component covalent organic frameworks

    Article • Chemical Communications, January 2023, Royal Society of Chemistry

    Dr Andrew Tarzia

  15. Modeling the Effect of Defects and Disorder in Amorphous Metal–Organic Frameworks

    Article • Chemistry of Materials, October 2022, American Chemical Society (ACS)

    Dr Andrew Tarzia

  16. Into the Unknown: How Computation Can Help Explore Uncharted Material Space

    Article • Journal of the American Chemical Society, October 2022, American Chemical Society (ACS)

    Dr Andrew Tarzia

  17. Water Sorption Controls Extreme Single‐Crystal‐to‐Single‐Crystal Molecular Reorganization in Hydrogen Bonded Organic Frameworks

    Article • Chemistry - A European Journal, August 2022, Wiley

    Dr Andrew Tarzia

  18. Unlocking the computational design of metal–organic cages

    Article • Chemical Communications, January 2022, Royal Society of Chemistry

    Dr Andrew Tarzia

  19. Orientational self-sorting in cuboctahedral Pd cages

    Article • Chemical Science, January 2022, Royal Society of Chemistry

    Dr Andrew Tarzia

  20. Modular Type III Porous Liquids Based on Porous Organic Cage Microparticles

    Article • Advanced Functional Materials, September 2021, Wiley

    Dr Andrew Tarzia

  21. High‐Throughput Computational Evaluation of Low Symmetry Pd2L4 Cages to Aid in System Design**

    Article • Angewandte Chemie, August 2021, Wiley

    Dr Andrew Tarzia

  22. High‐Throughput Computational Evaluation of Low Symmetry Pd2L4 Cages to Aid in System Design**

    Article • Angewandte Chemie, August 2021, Wiley

    Dr Andrew Tarzia

  23. Sterics and Hydrogen Bonding Control Stereochemistry and Self-Sorting in BINOL-Based Assemblies

    Article • Journal of the American Chemical Society, June 2021, American Chemical Society (ACS)

    Dr Andrew Tarzia

  24. stk: An extendable Python framework for automated molecular and supramolecular structure assembly and discovery

    Article • The Journal of Chemical Physics, June 2021, American Institute of Physics

    Dr Kim E Jelfs, Dr Andrew Tarzia

  25. High-throughput Computational Evaluation of Low Symmetry Pd2L4 Cages to Aid in System Design

    Article • May 2021, American Chemical Society (ACS)

    Dr Andrew Tarzia

  26. High-throughput Computational Evaluation of Low Symmetry Pd2L4 Cages to Aid in System Design

    Article • May 2021, American Chemical Society (ACS)

    Dr Andrew Tarzia

  27. Stk: An Extendable Python Framework for Automated Molecular and Supramolecular Structure Assembly and Discovery

    Article • May 2021, American Chemical Society (ACS)

    Dr Andrew Tarzia

  28. Stk: An Extendable Python Framework for Automated Molecular and Supramolecular Structure Assembly and Discovery

    Article • May 2021, American Chemical Society (ACS)

    Dr Andrew Tarzia

  29. Stk: An Extendable Python Framework for Automated Molecular and Supramolecular Structure Assembly and Discovery

    Article • March 2021, American Chemical Society (ACS)

    Dr Andrew Tarzia

  30. Artificial Intelligence Applied to the Prediction of Organic Materials

    Article • July 2020, Royal Society of Chemistry

    Dr Andrew Tarzia

  31. N -Aryl–linked spirocyclic polymers for membrane separations of complex hydrocarbon mixtures

    Article • Science, July 2020, American Association for the Advancement of Science

    Dr Andrew Tarzia

  32. Conformational control of Pd2L4 assemblies with unsymmetrical ligands

    Article • Chemical Science, January 2020, Royal Society of Chemistry

    Dr Andrew Tarzia

  33. Molecular Tectonics: A Node‐and‐Linker Building Block Approach to a Family of Hydrogen‐Bonded Frameworks

    Article • Chemistry - A European Journal, July 2019, Wiley

    Dr Andrew Tarzia

  34. Molecular Tectonics: A Node-and-Linker Building Block Approach to a Family of Hydrogen Bonded Frameworks

    Article • May 2019, American Chemical Society (ACS)

    Dr Andrew Tarzia

  35. Molecular Tectonics: A Node-and-Linker Building Block Approach to a Family of Hydrogen Bonded Frameworks

    Article • May 2019, American Chemical Society (ACS)

    Dr Andrew Tarzia

  36. Enhanced Activity of Enzymes Encapsulated in Hydrophilic Metal–Organic Frameworks

    Article • Journal of the American Chemical Society, January 2019, American Chemical Society (ACS)

    Dr Andrew Tarzia

  37. Carbohydrates@MOFs

    Article • Materials Horizons, January 2019, Royal Society of Chemistry

    Dr Andrew Tarzia

  38. High-Throughput Screening of Metal–Organic Frameworks for Macroscale Heteroepitaxial Alignment

    Article • ACS Applied Materials & Interfaces, October 2018, American Chemical Society (ACS)

    Dr Andrew Tarzia

  39. Protein surface functionalisation as a general strategy for facilitating biomimetic mineralisation of ZIF-8

    Article • Chemical Science, January 2018, Royal Society of Chemistry

    Dr Andrew Tarzia

  40. Synthesis, isomerisation and biological properties of mononuclear ruthenium complexes containing the bis[4(4′-methyl-2,2′-bipyridyl)]-1,7-heptane ligand

    Article • Dalton Transactions, January 2018, Royal Society of Chemistry

    Dr Andrew Tarzia

  41. Molecular Insight into Assembly Mechanisms of Porous Aromatic Frameworks

    Article • The Journal of Physical Chemistry C, July 2017, American Chemical Society (ACS)

    Dr Andrew Tarzia

  42. Supramolecular anion recognition in water: synthesis of hydrogen-bonded supramolecular frameworks

    Article • Chemical Science, January 2017, Royal Society of Chemistry

    Dr Andrew Tarzia

  43. Site-specific metal and ligand substitutions in a microporous Mn2+-based metal–organic framework

    Article • Dalton Transactions, January 2016, Royal Society of Chemistry

    Dr Andrew Tarzia