Now showing items 1-3 of 53842

    • Generalizable, fast, and accurate DeepQSPR with fastprop 

      Burns, Jackson W; Green, William H (Springer Science and Business Media LLC, 2025-05-13)
      Quantitative Structure–Property Relationship studies (QSPR), often referred to interchangeably as QSAR, seek to establish a mapping between molecular structure and an arbitrary target property. Historically this was done ...
    • Supercoiling-mediated feedback rapidly couples and tunes transcription 

      Johnstone, Christopher P; Galloway, Kate E (Elsevier BV, 2022-10)
      Transcription induces a wave of DNA supercoiling, altering the binding affinity of RNA polymerases and reshaping the biochemical landscape of gene regulation. As supercoiling rapidly diffuses, transcription dynamically ...
    • Quantum Differential Equation Solvers: Limitations and Fast-Forwarding 

      An, Dong; Liu, Jin-Peng; Wang, Daochen; Zhao, Qi (Springer Berlin Heidelberg, 2025-07-02)
      We study the limitations and fast-forwarding of quantum algorithms for linear ordinary differential equation (ODE) systems with a particular focus on non-quantum dynamics, where the coefficient matrix in the ODE is not ...