Showing 2,461 - 2,480 results of 7,728 for search '(programa OR programs) computational', query time: 0.12s Refine Results
  1. 2461
  2. 2462
  3. 2463
  4. 2464
  5. 2465

    Revisiting the "satisfaction of spatial restraints" approach of MODELLER for protein homology modeling. by Giacomo Janson, Alessandro Grottesi, Marco Pietrosanto, Gabriele Ausiello, Giulia Guarguaglini, Alessandro Paiardini

    Published 2019-12-01
    “…In this work, we have explored the idea of modifying MODELLER with two effective, yet computationally light strategies to improve its 3D modeling performance. …”
    Get full text
    Article
  6. 2466
  7. 2467

    Application of improved particle swarm optimization algorithm combined with genetic algorithm in shear wall design by Wei Gao

    Published 2025-12-01
    “…The example results show that when using the designed shear wall design program for scheme design, the success rate reaches 100 %, which is 38.47 % higher than the original particle swarm optimization algorithm. …”
    Get full text
    Article
  8. 2468
  9. 2469

    BETASCAN: probable beta-amyloids identified by pairwise probabilistic analysis. by Allen W Bryan, Matthew Menke, Lenore J Cowen, Susan L Lindquist, Bonnie Berger

    Published 2009-03-01
    “…The program then determines the strands and pairs with the greatest local likelihood for all of the sequence's potential beta-structures. …”
    Get full text
    Article
  10. 2470
  11. 2471
  12. 2472
  13. 2473
  14. 2474
  15. 2475

    JAX-BTE: a GPU-accelerated differentiable solver for phonon Boltzmann transport equations by Wenjie Shang, Jiahang Zhou, J. P. Panda, Zhihao Xu, Yi Liu, Pan Du, Jian-Xun Wang, Tengfei Luo

    Published 2025-05-01
    “…Abstract This paper introduces JAX-BTE, a GPU-accelerated, differentiable solver for the phonon Boltzmann Transport Equation (BTE) based on differentiable programming. JAX-BTE enables accurate, efficient and differentiable multiscale thermal modeling by leveraging high-performance GPU computing and automatic differentiation. …”
    Get full text
    Article
  16. 2476

    SPACIER: on-demand polymer design with fully automated all-atom classical molecular dynamics integrated into machine learning pipelines by Shun Nanjo, Arifin, Hayato Maeda, Yoshihiro Hayashi, Kan Hatakeyama-Sato, Ryoji Himeno, Teruaki Hayakawa, Ryo Yoshida

    Published 2025-01-01
    “…However, the enormous computational costs and technical challenges of automating computer experiments for polymeric materials have limited the availability of open-source automated polymer design systems that integrate molecular simulations and machine learning. …”
    Get full text
    Article
  17. 2477
  18. 2478
  19. 2479

    Nonparametric serial interval estimation with uniform mixtures. by Oswaldo Gressani, Niel Hens

    Published 2025-08-01
    “…Algorithms underlying our approach are simple, stable, and computationally inexpensive, making them easily implementable in a programming language that is most familiar to a potential user. …”
    Get full text
    Article
  20. 2480