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  1. 1

    PyFasma: an open-source, modular Python package for preprocessing and multivariate analysis of Raman spectroscopy data by Pavlou, Eleftherios, Kourkoumelis, Nikolaos

    ISSN: 1364-5528, 1364-5528
    Published: England 07.07.2025
    Published in Analyst (London) (07.07.2025)
    “… We present PyFasma, an open-source Python package for Raman spectroscopy, integrating essential preprocessing tools…”
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    Journal Article
  2. 2

    mspacman: A modular python package for three-dimensional (3D) partial volume corrected particle characterization using X-ray computed tomography by Gupta, Shuvam

    ISSN: 2352-7110, 2352-7110
    Published: Elsevier B.V 01.09.2025
    Published in SoftwareX (01.09.2025)
    “…•Modular Python package for 3D CT particle characterization with partial volume correction…”
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    Journal Article
  3. 3

    pymodconn: A python package for developing modular sequence-to-sequence control-oriented deep neural networks by Chaudhary, Gaurav, Johra, Hicham, Georges, Laurent, Austbø, Bjørn

    ISSN: 2352-7110, 2352-7110
    Published: Elsevier 01.12.2023
    Published in SoftwareX (01.12.2023)
    “…This paper introduces ''pymodconn'', a comprehensive python package developed for constructing modular sequence-to-sequence control-oriented deep neural networks…”
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    Journal Article
  4. 4

    FluidSim: Modular, Object-Oriented Python Package for High-Performance CFD Simulations by Mohanan, Ashwin Vishnu, Bonamy, Cyrille, Linares, Miguel Calpe, Augier, Pierre

    ISSN: 2049-9647, 2049-9647
    Published: Ubiquity Press 26.04.2019
    Published in Journal of open research software (26.04.2019)
    “…The Python package fluidsim is introduced in this article as an extensible framework for Computational Fluid Mechanics (CFD) solvers…”
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    Journal Article
  5. 5

    DomainLab: A modular Python package for domain generalization in deep learning by Sun, Xudong, Feistner, Carla, Gossmann, Alexej, Schwarz, George, Rao, Muhammad Umer, Beer, Lisa, Rockenschaub, Patrick, Rahul Babu Shrestha, Gruber, Armin, Chen, Nutan, Sayedali Shetab Boushehri, Buettner, Florian, Marr, Carsten

    ISSN: 2331-8422
    Published: Ithaca Cornell University Library, arXiv.org 21.03.2024
    Published in arXiv.org (21.03.2024)
    “… DomainLab is a modular Python package for training user specified neural networks with composable regularization loss terms…”
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    Paper
  6. 6
  7. 7

    The EVcouplings Python framework for coevolutionary sequence analysis by Hopf, Thomas A, Green, Anna G, Schubert, Benjamin, Mersmann, Sophia, Schärfe, Charlotta P I, Ingraham, John B, Toth-Petroczy, Agnes, Brock, Kelly, Riesselman, Adam J, Palmedo, Perry, Kang, Chan, Sheridan, Robert, Draizen, Eli J, Dallago, Christian, Sander, Chris, Marks, Debora S

    ISSN: 1367-4803, 1367-4811, 1367-4811
    Published: England Oxford University Press 01.05.2019
    Published in Bioinformatics (Oxford, England) (01.05.2019)
    “…), and de novo prediction of structure and mutation effects. The combination of an easy to use, flexible command line interface and an underlying modular Python package…”
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    Journal Article
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  9. 9

    ProPythia: A Python package for protein classification based on machine and deep learning by Sequeira, Ana Marta, Lousa, Diana, Rocha, Miguel

    ISSN: 0925-2312, 1872-8286
    Published: Elsevier B.V 01.05.2022
    Published in Neurocomputing (Amsterdam) (01.05.2022)
    “…The field of protein data mining has been growing rapidly in the last years. To characterize proteins and determine their function from their amino acid…”
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    Journal Article
  10. 10

    kMCpy: A python package to simulate transport properties in solids with kinetic Monte Carlo by Deng, Zeyu, Mishra, Tara P., Xie, Weihang, Saeed, Daanyal Ahmed, Gautam, Gopalakrishnan Sai, Canepa, Pieremanuele

    ISSN: 0927-0256, 1879-0801
    Published: Elsevier B.V 05.10.2023
    Published in Computational materials science (05.10.2023)
    “… Here, we present kMCpy, a lightweight, customizable, and modular python package to compute the ionic transport properties in crystalline materials using kMC…”
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    Journal Article
  11. 11

    FluidSim: modular, object-oriented Python package for high-performance CFD simulations by Mohanan, Ashwin Vishnu, Bonamy, Cyrille, Miguel Calpe Linares, Augier, Pierre

    ISSN: 2331-8422
    Published: Ithaca Cornell University Library, arXiv.org 03.07.2018
    Published in arXiv.org (03.07.2018)
    “…The Python package fluidsim is introduced in this article as an extensible framework for Computational Fluid Mechanics (CFD) solvers…”
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    Paper
  12. 12

    QuakeMigrate: a Modular, Open-Source Python Package for Automatic Earthquake Detection and Location by Winder, Tom, Bacon, Conor, Smith, Jonathan, Hudson, Thomas, Greenfield, Tim, White, Robert

    Published: Washington American Geophysical Union 16.01.2021
    “… QuakeMigrate is a new modular, open-source python package providing a framework to efficiently…”
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    Paper
  13. 13

    Mocafe: a comprehensive Python library for simulating cancer development with Phase Field Models by Pradelli, Franco, Minervini, Giovanni, Tosatto, Silvio C E

    ISSN: 1367-4803, 1367-4811, 1367-4811
    Published: England 15.09.2022
    Published in Bioinformatics (Oxford, England) (15.09.2022)
    “… To reduce this gap, we developed Mocafe, a modular open-source Python package that implements some of the most important PFMs reported in the literature…”
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    Journal Article
  14. 14

    Python Group Additivity (pGrAdd) software for estimating species thermochemical properties by Wittreich, Gerhard R., Vlachos, Dionisios G.

    ISSN: 0010-4655, 1879-2944
    Published: Netherlands Elsevier B.V 01.04.2022
    Published in Computer physics communications (01.04.2022)
    “… We introduce the Python Group Additivity software (pGrAdd) that implements comprehensive group additivity in a simple, modular, lightweight Python package that is extensible and easy to implement…”
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  15. 15

    CELL: a Python package for cluster expansion with a focus on complex alloys by Rigamonti, Santiago, Troppenz, Maria, Kuban, Martin, Hübner, Axel, Draxl, Claudia

    ISSN: 2057-3960, 2057-3960
    Published: London Nature Publishing Group UK 30.08.2024
    Published in npj computational materials (30.08.2024)
    “…We present the Python package CELL, which provides a modular approach to the cluster expansion (CE) method…”
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  16. 16

    Catalight─An Open-Source Automated Photocatalytic Reactor Package Illustrated through Plasmonic Acetylene Hydrogenation by Bourgeois, B B, Dai, A X, Carlin, C C, Yuan, L, Al-Zubeidi, A, Cheng, W H, Swearer, D F, Dionne, J A

    ISSN: 1520-5215, 1520-5215
    Published: United States 10.07.2025
    “…An open-source and modular Python package, Catalight, is developed and demonstrated to automate (photo…”
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  17. 17

    Pyeo: A Python package for near-real-time forest cover change detection from Earth observation using machine learning by Roberts, J.F., Mwangi, R., Mukabi, F., Njui, J., Nzioka, K., Ndambiri, J.K., Bispo, P.C., Espirito-Santo, F.D.B., Gou, Y., Johnson, S.C.M., Louis, V., Pacheco-Pascagaza, A.M., Rodriguez-Veiga, P., Tansey, K., Upton, C., Robb, C., Balzter, H.

    ISSN: 0098-3004
    Published: Elsevier Ltd 01.10.2022
    Published in Computers & geosciences (01.10.2022)
    “… Once trained, a machine learning model can be applied to new images automatically. This paper introduces the open-access Python 3 package Pyeo…”
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  18. 18

    ModeHunter: A Package for the Reductionist Analysis, Animation, and Application of Elastic Biomolecular Motion by Wriggers, Willy, Alshammari, Maytha, Stember, Joseph N, Stolzenberg, Sebastian, Metwally, Essam, Auer, Manfred, He, Jing, Weinstein, Harel

    ISSN: 1520-5207, 1520-5207
    Published: United States 23.01.2025
    Published in The journal of physical chemistry. B (23.01.2025)
    “…ModeHunter is a modular Python software package for the simulation of 3D biophysical motion across spatial resolution scales using modal analysis of elastic networks…”
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  19. 19

    diel_models: a python package for systematic integration of day–night cycles into plant genome-scale metabolic models by Martins, Luciana, Capela, João, Cunha, Emanuel, Sampaio, Marta, Dias, Oscar

    ISSN: 2635-0041, 2635-0041
    Published: England Oxford University Press 01.01.2025
    Published in Bioinformatics advances (01.01.2025)
    “… diel_models is a lightweight, modular package with minimal dependencies and broad Python compatibility (v3.8…”
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  20. 20

    A Python Multiscale Thermochemistry Toolbox (pMuTT) for thermochemical and kinetic parameter estimation by Lym, Jonathan, Wittreich, Gerhard R., Vlachos, Dionisios G.

    ISSN: 0010-4655, 1879-2944
    Published: Netherlands Elsevier B.V 01.02.2020
    Published in Computer physics communications (01.02.2020)
    “… The Python multiscale thermochemistry toolbox (pMuTT) is a Python software library developed to streamline the conversion of ab-initio data to thermochemical properties…”
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    Journal Article