But AlphaShapes.jl, part of the Julia general package registry, and Consensus may interest you!

DL_POLY (Classical Molecular Dynamics, Fortran90-2018, MPI, CMake) and its Python meta package dlpoly-py, on a Postdoc at Queen Mary University of London

I'm also developing Active Matter simulations in DL_POLY

• C++, Fortran, Rust, shell (bash), Python, Julia, Kotlin, Lua, Javascript (+html/css), C

• MPI, CMake, HPC Schedulers (SLURM/UGE), OpenGL, Vulkan, Android (Jetpack Compose, Kotlin, C++ NDK), CUDA (C++, Fortran), OpenAcc, GCloud, AWS (lambda mostly), git, github/gitlab

• CCP5 AGM September 11-13th 2023 - Poster

• CoSeC Annual Conference 6th December 2023 - Slides

• CCP5 AGM September 11-13th 2023 - Slides

• DARS-SWARM 2021 (June 1st - 4th) (a) Corralled Active Brownian Particles: Whirligig Beetles show a density dependent speed with MIPS-like, co-existing high and low density phases, Devereux HL (Presenting), Twomey CR, Turner MS, Thutupalli S.

• DARS-SWARM 2021 (June 1st - 4th) (b) Bottom-up models of swarming and the entropy of visual states, Devereux HL (Presenting), Turner MS.

• Withington, M., Devereux, H.L., Cockrell, C., Elena, A.M., Todorov, I.T., Liu, Z.K., Shang, S.L., McCloy, J.S., Bingham, P.A. and Trachenko, K., 2024. Viscosity bounds in liquids with different structure and bonding types. Physical Review B, 109(9), p.094205. https://doi.org/10.1103/PhysRevB.109. (Open Access)

• Devereux, HL. and Turner, MS., 2023. Environmental path-entropy and collective motion. Physical Review Letters, 130(16), p.168201. https://doi.org/10.1103/PhysRevLett.130.168201 (Open Access)

• Devereux HL, Twomey CR, Turner MS, Thutupalli S. 2021 Whirligig beetles as corralled active Brownian particles. J. R. Soc. Interface 18: 20210114. https://doi.org/10.1098/rsif.2021.0114 (ArXiv - https://arxiv.org/abs/2104.03080)

• Material Chemistry Consortium (MCC) compute time on ARCHER2, the UK National Supercomputing Service.

• EPSRC and MRC Centre for Doctoral Training in Mathematics for Real-World Systems, EP/L015374/1 (PhD Studentship 2017-2021) Inc. 3-month fully-funded coronavirus extension.

• Warwick-Turing AI Research Strategy Scheme Postdoc

• HPC compute time: Joint Usage/Research Center for Interdisciplinary Large-scale Information Infrastructures” and ”High Performance Computing Infrastructure” in Japan Project ID: jh220054