期刊ISSN1759-0876 期刊全称Wiley Interdisciplinary Reviews-computational Molecular Science 期刊缩写Wires Comput Mol Sci 影响因子14.016 自引率1.10% SCI 收录情况SCIE收录; ESI 学科分类化学(Chemistry) 中科院大类分区生物:1区 中科院小类分区化学综合2区
WIREs Computational Molecular Science将审查并突出所有这些领域的研究。 英文简介 The computational molecular sciences utilize the techniques of rigorous chemical as well as physical theories and computer-based modeling, relying on specialized hardware and software development, algorithm design, and database ...
近日,吉林大学生命科学学院田圃教授应邀在国际著名期刊WIREs Computational Molecular Science发表原创局部分布理论综述论文(The repetitive local sampling and the local distribution theory. WIREs Computational Molecular Science, 2021, e1588)。 深度学习在生物大分子静态结构预测中取得了巨大进展(Nature, 596:583-589, ...
近年来在Advanced Science, National Science Review, ACS Nano, Physical Chemistry Chemical Physics, Journal of Materials Chemistry A, WIREs Computational Molecular Science等期刊上以第一作者或合作研究发表SCI论文近10篇,主持国家自然科学基金...
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In fact, in the worst-case scenario, the computational complexity of simple algorithms scales exponentially with the number N of electrons47 and computing the SCE functional may be NP-hard.46, 48, 49 In the discrete setting, where the single particle density ρ is supported on ℓ points, ...