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  1. 1

    The CoLoMoTo Interactive Notebook: Accessible and Reproducible Computational Analyses for Qualitative Biological Networks by Naldi, Aurélien, Hernandez, Céline, Levy, Nicolas, Stoll, Gautier, Monteiro, Pedro T., Chaouiya, Claudine, Helikar, Tomáš, Zinovyev, Andrei, Calzone, Laurence, Cohen-Boulakia, Sarah, Thieffry, Denis, Paulevé, Loïc

    ISSN: 1664-042X, 1664-042X
    Published: Switzerland Frontiers 19.06.2018
    Published in Frontiers in physiology (19.06.2018)
    “… The accessibility and reproducibility of such workflows is challenging, as publications often overlook analysis details, and because some of these tools may be difficult to install, and/or have a steep learning curve…”
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    Journal Article
  2. 2

    Development of a New Thermal-Hydraulic Module for FRENETIC, a Code for the Multiphysics Analysis of Liquid Metal-Cooled Reactors by Lombardo, Antonino, Nallo, Giuseppe F., Abrate, Nicolò, Liu, Yapeng, Dulla, Sandra

    ISSN: 0029-5450, 1943-7471
    Published: La Grange Park Taylor & Francis 03.10.2025
    Published in Nuclear technology (03.10.2025)
    “… The code performs steady-state and transient neutronic (NE) and TH coupled calculations while maintaining a relatively low computational cost thanks to the adoption of simplified physical models…”
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  3. 3

    Avogadro: an advanced semantic chemical editor, visualization, and analysis platform by Hanwell, Marcus D, Curtis, Donald E, Lonie, David C, Vandermeersch, Tim, Zurek, Eva, Hutchison, Geoffrey R

    ISSN: 1758-2946, 1758-2946
    Published: Cham Springer International Publishing 13.08.2012
    Published in Journal of cheminformatics (13.08.2012)
    “… Results The work presented here details the Avogadro library, which is a framework providing a code library and application programming interface (API…”
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  4. 4

    Identification of Novel Microcystins Using High-Resolution MS and MSn with Python Code by Baliu-Rodriguez, David, Peraino, Nicholas J, Premathilaka, Sanduni H, Birbeck, Johnna A, Baliu-Rodriguez, Tomás, Westrick, Judy A, Isailovic, Dragan

    ISSN: 1520-5851, 1520-5851
    Published: 01.02.2022
    Published in Environmental science & technology (01.02.2022)
    “…Cyanotoxins called microcystins (MCs) are highly toxic and can be present in drinking water sources. Determining the structure of MCs is paramount because of…”
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  5. 5

    REGALS : a general method to deconvolve X-ray scattering data from evolving mixtures by Meisburger, Steve P., Xu, Da, Ando, Nozomi

    ISSN: 2052-2525, 2052-2525
    Published: England International Union of Crystallography 01.03.2021
    Published in IUCrJ (01.03.2021)
    “…Mixtures of biological macromolecules are inherently difficult to study using structural methods, as increasing complexity presents new challenges for data analysis…”
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  6. 6

    From code to reliability: Python-powered Paraconsistent Logic for alarm detection in the power gris/ Do codigo a confiabilidade: Logica Paraconsistente impulsionada por Python para a deteccao de alarmes na rede de energia by de Oliveira, Joseffe Barroso, Gino, Joao Vitor Santa Rosa, de Lima, Carlos Jose, Filho, Joao Inacio da Silva

    ISSN: 2178-9010, 2178-9010
    Published: Sindicato das Secretarias e Secretarios do Estado de Sao Paulo 01.10.2023
    Published in GeSec : Revista de Gestão e Secretariado (01.10.2023)
    “… This application enables the comparison of triggered alarms with the resultant logical states obtained during the analysis…”
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  7. 7
  8. 8

    PyLAT: Python LAMMPS Analysis Tools by Humbert, Michael T, Zhang, Yong, Maginn, Edward J

    ISSN: 1549-960X, 1549-960X
    Published: United States 22.04.2019
    “… Here we describe a suite of open-source Python-based postprocessing routines we have developed called PyLAT…”
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  9. 9

    GSEApy: a comprehensive package for performing gene set enrichment analysis in Python by Fang, Zhuoqing, Liu, Xinyuan, Peltz, Gary

    ISSN: 1367-4811, 1367-4803, 1367-4811
    Published: England Oxford University Press 01.01.2023
    Published in Bioinformatics (Oxford, England) (01.01.2023)
    “…Abstract Motivation Gene set enrichment analysis (GSEA) is a commonly used algorithm for characterizing gene expression changes…”
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  10. 10

    Pyteomics—a Python Framework for Exploratory Data Analysis and Rapid Software Prototyping in Proteomics by Goloborodko, Anton A., Levitsky, Lev I., Ivanov, Mark V., Gorshkov, Mikhail V.

    ISSN: 1044-0305, 1879-1123, 1879-1123
    Published: New York Springer-Verlag 01.02.2013
    “…Pyteomics is a cross-platform, open-source Python library providing a rich set of tools for MS-based proteomics…”
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  11. 11

    VULCAN: An Open-source, Validated Chemical Kinetics Python Code for Exoplanetary Atmospheres by Tsai, Shang-Min, Lyons, James R., Grosheintz, Luc, Rimmer, Paul B., Kitzmann, Daniel, Heng, Kevin

    ISSN: 0067-0049, 1538-4365
    Published: United States The American Astronomical Society 01.02.2017
    “…We present an open-source and validated chemical kinetics code for studying hot exoplanetary atmospheres, which we name VULCAN…”
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  12. 12

    PypKa: A Flexible Python Module for Poisson-Boltzmann-Based pKa Calculations by Reis, Pedro B P S, Vila-Viçosa, Diogo, Rocchia, Walter, Machuqueiro, Miguel

    ISSN: 1549-960X, 1549-960X
    Published: 26.10.2020
    “…The protonation of titratable residues has a significant impact on the structure and function of biomolecules, influencing many physicochemical and ADME…”
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  13. 13

    stk: A python toolkit for supramolecular assembly by Turcani, Lukas, Berardo, Enrico, Jelfs, Kim E.

    ISSN: 0192-8651, 1096-987X, 1096-987X
    Published: Hoboken, USA John Wiley & Sons, Inc 05.09.2018
    Published in Journal of computational chemistry (05.09.2018)
    “… stk is a modular, extensible and open‐source Python library that provides a simple Python API and integration with third party computational codes…”
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  14. 14

    Coherent manipulation of the internal state of ultracold 87Rb133Cs molecules with multiple microwave fields by Blackmore, Jacob A, Gregory, Philip D, Bromley, Sarah L, Cornish, Simon L

    ISSN: 1463-9084, 1463-9084
    Published: 21.12.2020
    Published in Physical chemistry chemical physics : PCCP (21.12.2020)
    “…We explore coherent multi-photon processes in 87Rb133Cs molecules using 3-level lambda and ladder configurations of rotational and hyperfine states, and discuss their relevance to future applications…”
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  15. 15

    scFates: a scalable python package for advanced pseudotime and bifurcation analysis from single-cell data by Faure, Louis, Soldatov, Ruslan, Kharchenko, Peter V, Adameyko, Igor

    ISSN: 1367-4811, 1367-4803, 1367-4811
    Published: England Oxford University Press 01.01.2023
    Published in Bioinformatics (Oxford, England) (01.01.2023)
    “…Abstract Summary scFates provides an extensive toolset for the analysis of dynamic trajectories comprising tree learning, feature association testing, branch differential expression and with a…”
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  16. 16

    MechElastic: A Python library for analysis of mechanical and elastic properties of bulk and 2D materials by Singh, Sobhit, Lang, Logan, Dovale-Farelo, Viviana, Herath, Uthpala, Tavadze, Pedram, Coudert, François-Xavier, Romero, Aldo H.

    ISSN: 0010-4655, 1879-2944
    Published: United States Elsevier B.V 01.10.2021
    Published in Computer physics communications (01.10.2021)
    “…The MechElastic Python package evaluates the mechanical and elastic properties of bulk and 2D materials using the elastic coefficient matrix (Cij…”
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  17. 17

    The fast azimuthal integration Python library: pyFAI by Ashiotis, Giannis, Deschildre, Aurore, Nawaz, Zubair, Wright, Jonathan P., Karkoulis, Dimitrios, Picca, Frédéric Emmanuel, Kieffer, Jérôme

    ISSN: 1600-5767, 0021-8898, 1600-5767
    Published: 5 Abbey Square, Chester, Cheshire CH1 2HU, England International Union of Crystallography 01.04.2015
    Published in Journal of applied crystallography (01.04.2015)
    “… It is written in Python (with binary submodules for improved performance), a language widely accepted and used by the scientific community today, which enables users to easily incorporate the pyFAI library into their processing pipeline…”
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  18. 18

    pyIAST: Ideal adsorbed solution theory (IAST) Python package by Simon, Cory M., Smit, Berend, Haranczyk, Maciej

    ISSN: 0010-4655, 1879-2944
    Published: Netherlands Elsevier B.V 01.03.2016
    Published in Computer physics communications (01.03.2016)
    “… We present an open-source, user-friendly Python package, pyIAST, to perform IAST calculations for an arbitrary number of components…”
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  19. 19

    Short communication: age2exhume – a MATLAB/Python script to calculate steady-state vertical exhumation rates from thermochronometric ages and application to the Himalaya by van der Beek, Peter, Schildgen, Taylor F.

    ISSN: 2628-3719, 2628-3697, 2628-3719
    Published: Göttingen Copernicus GmbH 16.01.2023
    Published in Geochronology (Göttingen. Online) (16.01.2023)
    “… datasets in such models remains challenging. Here, we present age2exhume, a thermal model in the form of a MATLAB or Python script, which can be used to rapidly obtain…”
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  20. 20

    Machine Learning-Enabled Quantitative Analysis of Optically Obscure Scratches on Nickel-Plated Additively Manufactured (AM) Samples by Mengesha, Betelhiem N., Grizzle, Andrew C., Demisse, Wondwosen, Klein, Kate L., Elliott, Amy, Tyagi, Pawan

    ISSN: 1996-1944, 1996-1944
    Published: Basel MDPI AG 20.09.2023
    Published in Materials (20.09.2023)
    “…Additively manufactured metal components often have rough and uneven surfaces, necessitating post-processing and surface polishing. Hardness is a critical…”
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