Suchergebnisse - "python library"

  1. 1

    COMBO: An efficient Bayesian optimization library for materials science von Ueno, Tsuyoshi, Rhone, Trevor David, Hou, Zhufeng, Mizoguchi, Teruyasu, Tsuda, Koji

    ISSN: 2352-9245, 2352-9245
    Veröffentlicht: Elsevier Ltd 01.06.2016
    Veröffentlicht in Materials discovery (01.06.2016)
    “… [Display omitted] In many subfields of chemistry and physics, numerous attempts have been made to accelerate scientific discovery using data-driven …”
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  2. 2

    GP+: A Python library for kernel-based learning via Gaussian processes von Yousefpour, Amin, Foumani, Zahra Zanjani, Shishehbor, Mehdi, Mora, Carlos, Bostanabad, Ramin

    ISSN: 0965-9978
    Veröffentlicht: Elsevier Ltd 01.09.2024
    Veröffentlicht in Advances in engineering software (1992) (01.09.2024)
    “… In this paper we introduce GP+, an open-source library for kernel-based learning via Gaussian processes (GPs) which are powerful statistical models that are …”
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  3. 3

    Pixyz: a Python library for developing deep generative models von Suzuki, Masahiro, Kaneko, Takaaki, Matsuo, Yutaka

    ISSN: 0169-1864, 1568-5535
    Veröffentlicht: Taylor & Francis 02.10.2023
    Veröffentlicht in Advanced robotics (02.10.2023)
    “… With the recent rapid progress in the study of deep generative models (DGMs), there is a need for a framework that can implement them in a simple and generic …”
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  4. 4

    MAPAL: A python library for mapping features and properties of alloys over compositional spaces von Beniwal, Dishant, Ray, Pratik K.

    ISSN: 0927-0256
    Veröffentlicht: Elsevier B.V 30.01.2026
    Veröffentlicht in Computational materials science (30.01.2026)
    “… Compositional machine learning (ML) models have emerged as a promising high throughput approach to probe the properties and behavior of a wide variety of …”
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  5. 5

    ChemTS: an efficient python library for de novo molecular generation von Yang, Xiufeng, Zhang, Jinzhe, Yoshizoe, Kazuki, Terayama, Kei, Tsuda, Koji

    ISSN: 1468-6996, 1878-5514
    Veröffentlicht: United States Taylor & Francis 31.12.2017
    Veröffentlicht in Science and technology of advanced materials (31.12.2017)
    “… Automatic design of organic materials requires black-box optimization in a vast chemical space. In conventional molecular design algorithms, a molecule is …”
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  6. 6

    EEGraph: An open-source Python library for modeling electroencephalograms using graphs von Maitin, Ana M., Nogales, Alberto, Chazarra, Pedro, García-Tejedor, Álvaro José

    ISSN: 0925-2312, 1872-8286
    Veröffentlicht: Elsevier B.V 28.01.2023
    Veröffentlicht in Neurocomputing (Amsterdam) (28.01.2023)
    “… •Open-source Python library for graph-based EEG modeling using connectivity measures.•Includes several connectivity measures, related to time and frequency …”
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  7. 7

    IntelELM: A python framework for intelligent metaheuristic-based extreme learning machine von Van Thieu, Nguyen, Houssein, Essam H., Oliva, Diego, Hung, Nguyen Duy

    ISSN: 0925-2312
    Veröffentlicht: Elsevier B.V 14.02.2025
    Veröffentlicht in Neurocomputing (Amsterdam) (14.02.2025)
    “… This study introduces IntelELM, an open-source Python library designed for hybrid neural networks that integrate Extreme Learning Machine (ELM) with …”
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  8. 8

    fromage: A library for the study of molecular crystal excited states at the aggregate scale von Rivera, Miguel, Dommett, Michael, Sidat, Amir, Rahim, Warda, Crespo‐Otero, Rachel

    ISSN: 0192-8651, 1096-987X, 1096-987X
    Veröffentlicht: Hoboken, USA John Wiley & Sons, Inc 15.04.2020
    Veröffentlicht in Journal of computational chemistry (15.04.2020)
    “… The study of photoexcitations in molecular aggregates faces the twofold problem of the increased computational cost associated with excited states and the …”
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  9. 9

    QIDLearningLib: A Python library for quasi-identifier recognition and evaluation von Amaral Simões, Sancho, Vilela, João P., Seoane Santos, Miriam, Henriques Abreu, Pedro

    ISSN: 0925-2312
    Veröffentlicht: Elsevier B.V 14.11.2025
    Veröffentlicht in Neurocomputing (Amsterdam) (14.11.2025)
    “… Quasi-identifiers (QIDs) are attributes in a dataset that are not directly unique identifiers of the users/entities themselves but can be used, often in …”
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  10. 10

    Characterizing and detecting Python version incompatibilities caused by inconsistent version specifications von Li, Shuo, Gao, Haocheng, Chen, Wei, Li, Yi, Tian, Haoxiang, Liu, Chengwei, Ye, Dan

    ISSN: 0164-1212
    Veröffentlicht: Elsevier Inc 01.04.2025
    Veröffentlicht in The Journal of systems and software (01.04.2025)
    “… Python interpreter serves as the foundation for developing Python projects. Configuring compatible Python version is essential for packaging and reusing …”
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  11. 11

    IOData: A python library for reading, writing, and converting computational chemistry file formats and generating input files von Verstraelen, Toon, Adams, William, Pujal, Leila, Tehrani, Alireza, Kelly, Braden D., Macaya, Luis, Meng, Fanwang, Richer, Michael, Hernández‐Esparza, Raymundo, Yang, Xiaotian Derrick, Chan, Matthew, Kim, Taewon David, Cools‐Ceuppens, Maarten, Chuiko, Valerii, Vöhringer‐Martinez, Esteban, Ayers, Paul W., Heidar‐Zadeh, Farnaz

    ISSN: 0192-8651, 1096-987X, 1096-987X
    Veröffentlicht: Hoboken, USA John Wiley & Sons, Inc 05.03.2021
    Veröffentlicht in Journal of computational chemistry (05.03.2021)
    “… IOData is a free and open‐source Python library for parsing, storing, and converting various file formats commonly used by quantum chemistry, molecular …”
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  12. 12

    ABCpy : A High-Performance Computing Perspective to Approximate Bayesian Computation von Dutta, Ritabrata, Schoengens, Marcel, Pacchiardi, Lorenzo, Ummadisingu, Avinash, Widmer, Nicole, Künzli, Pierre, Onnela, Jukka-Pekka, Mira, Antonietta

    ISSN: 1548-7660, 1548-7660
    Veröffentlicht: Foundation for Open Access Statistics 01.11.2021
    Veröffentlicht in Journal of statistical software (01.11.2021)
    “… ABCpy is a highly modular scientific library for approximate Bayesian computation (ABC) written in Python. The main contribution of this paper is to document a …”
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  13. 13

    PyBioMed: a python library for various molecular representations of chemicals, proteins and DNAs and their interactions von Dong, Jie, Yao, Zhi-Jiang, Zhang, Lin, Luo, Feijun, Lin, Qinlu, Lu, Ai-Ping, Chen, Alex F., Cao, Dong-Sheng

    ISSN: 1758-2946, 1758-2946
    Veröffentlicht: Cham Springer International Publishing 20.03.2018
    Veröffentlicht in Journal of cheminformatics (20.03.2018)
    “… Background With the increasing development of biotechnology and informatics technology, publicly available data in chemistry and biology are undergoing …”
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  14. 14

    MetaIBM: A Python-based library for individual-based modelling of eco-evolutionary dynamics in spatial-explicit metacommunities von Lin, Jian-Hao, Quan, Yu-Juan, Han, Bo-Ping

    ISSN: 0304-3800
    Veröffentlicht: Elsevier B.V 01.06.2024
    Veröffentlicht in Ecological modelling (01.06.2024)
    “… •We released a python library (MetaIBM) for individual-based modelling on GitHub.•The MetaIBM is suitable for a wide range of scenarios in metacommunity …”
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  15. 15

    MetaPerceptron: A standardized framework for metaheuristic-driven multi-layer perceptron optimization von Thieu, Nguyen Van, Mirjalili, Seyedali, Garg, Harish, Hoang, Nguyen Thanh

    ISSN: 0920-5489
    Veröffentlicht: Elsevier B.V 01.04.2025
    Veröffentlicht in Computer standards and interfaces (01.04.2025)
    “… •MetaPerceptron: an user-friendly and comprehensive metaheuristic-based MLP framework.•Supports regression and classification tasks with more than 200 …”
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  16. 16

    bmdrc: Python package for quantifying phenotypes from chemical exposures with benchmark dose modeling von Degnan, David J., Bramer, Lisa M., Truong, Lisa, Tanguay, Robyn L., Gosline, Sara M., Waters, Katrina M.

    ISSN: 1553-7358, 1553-734X, 1553-7358
    Veröffentlicht: United States Public Library of Science (PLoS) 28.07.2025
    Veröffentlicht in PLoS computational biology (28.07.2025)
    “… Though chemical exposures are known to potentially have negative impacts on health, including contributing to chronic diseases such as cancer, the quantitative …”
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  17. 17

    Unified Planning: Modeling, manipulating and solving AI planning problems in Python von Micheli, Andrea, Bit-Monnot, Arthur, Röger, Gabriele, Scala, Enrico, Valentini, Alessandro, Framba, Luca, Rovetta, Alberto, Trapasso, Alessandro, Bonassi, Luigi, Gerevini, Alfonso Emilio, Iocchi, Luca, Ingrand, Felix, Köckemann, Uwe, Patrizi, Fabio, Saetti, Alessandro, Serina, Ivan, Stock, Sebastian

    ISSN: 2352-7110, 2352-7110
    Veröffentlicht: Elsevier B.V 01.02.2025
    Veröffentlicht in SoftwareX (01.02.2025)
    “… Automated planning is a branch of artificial intelligence aiming at finding a course of action that achieves specified goals, given a description of the …”
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  18. 18

    TAT-HUM: Trajectory analysis toolkit for human movements in Python von Wang, Xiaoye Michael, Welsh, Timothy N.

    ISSN: 1554-3528, 1554-3528
    Veröffentlicht: New York Springer US 01.06.2024
    Veröffentlicht in Behavior research methods (01.06.2024)
    “… Human movement trajectories can reveal useful insights regarding the underlying mechanisms of human behaviors. Extracting information from movement …”
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  19. 19

    PyBanshee version (1.0): A Python implementation of the MATLAB toolbox BANSHEE for Non-Parametric Bayesian Networks with updated features von Koot, Paul, Mendoza-Lugo, Miguel Angel, Paprotny, Dominik, Morales-Nápoles, Oswaldo, Ragno, Elisa, Worm, Daniël T.H.

    ISSN: 2352-7110, 2352-7110
    Veröffentlicht: Elsevier B.V 01.02.2023
    Veröffentlicht in SoftwareX (01.02.2023)
    “… In this paper we discuss PyBanshee, which is a Python-based open-source implementation of the MATLAB toolbox BANSHEE. PyBanshee constitutes the first fully …”
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  20. 20

    Numerical Simulations on Nonlinear Quantum Graphs with the GraFiDi Library von Besse, Christophe, Duboscq, Romain, Le Coz, Stefan

    ISSN: 2426-8399, 2426-8399
    Veröffentlicht: Société de Mathématiques Appliquées et Industrielles (SMAI) 08.04.2022
    Veröffentlicht in SMAI Journal of Computational Mathematics (08.04.2022)
    “… Nonlinear quantum graphs are metric graphs equipped with a nonlinear Schrödinger equation. Whereas in the last ten years they have known considerable …”
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