Almeida J, Prior J, Plenio M B
†Institute for Theoretical Physics, University Ulm, Albert-Einstein-Allee 11, D-89069 Ulm, Germany.
§Institute for Integrated Quantum Science and Technology, University Ulm, Albert-Einstein-Allee 11, D-89069 Ulm, Germany.
J Phys Chem Lett. 2012 Sep 20;3(18):2692-6. doi: 10.1021/jz3009369. Epub 2012 Sep 11.
The computation of scientific data can be very time-consuming, even if they are ultimately determined by a small number of parameters. The principle of compressed sampling suggests that for typical data we can achieve a considerable decrease in the computation time by avoiding the need to sample the full data set. We demonstrate the usefulness of this approach at the hand of two-dimensional (2-D) spectra in the context of ultrafast nonlinear spectroscopy of biological systems where numerical calculations are highly challenging due to the considerable computational effort involved in obtaining individual data points.
科学数据的计算可能非常耗时,即使它们最终由少数参数决定。压缩采样原理表明,对于典型数据,我们可以通过避免对整个数据集进行采样来显著减少计算时间。我们在生物系统超快非线性光谱学背景下的二维(2-D)光谱方面展示了这种方法的有效性,在该领域中,由于获取单个数据点需要大量的计算工作,数值计算极具挑战性。