分子动力学模拟技术在生物分子研究中的进展
曹了然, 张春煜, 张鼎林, 楚慧郢, 张跃斌, 李国辉 - 物理化学学报, 2017 - whxb.pku.edu.cn
… polarizable force fields used as references in this work, not to mention the parameters of …
using the machine learning strategy to predict secondary structures of proteins192,193. For …
using the machine learning strategy to predict secondary structures of proteins192,193. For …
人工智能在锂离子电池研发中的应用
朱振威, 邱景义, 王莉, 曹高萍, 何向明, 王京… - 电 …, 2022 - electrochem.xmu.edu.cn
… is called machine learning, ML) has exhibited as an effective … network to obtain a ML force
field which maps configurations … identify the most critical parameters and then further speed …
field which maps configurations … identify the most critical parameters and then further speed …
[PDF][PDF] 人工智能驱动化学品创新设计的实践与展望
吴正浩, 周天航, 蓝兴英, 徐春明 - 化工进展, 2023 - researchgate.net
… For instance, machine learning models trained on … ., using AI to optimize existing physics-based
simulation techniques and efficiently explore hundreds of millions of design parameters …
simulation techniques and efficiently explore hundreds of millions of design parameters …
[PDF][PDF] 金属有机骨架的高通量计算筛选研究进展
刘治鲁, 李炜, 刘昊, 庄旭东, 李松 - Acta Chim. Sinica, 2019 - researchgate.net
… , in which the accuracy of force field parameters play a criticl role in the … Machine learning
consisting of various algorithms is a … At last, the investigations on the utilization of HTCS in CH4 …
consisting of various algorithms is a … At last, the investigations on the utilization of HTCS in CH4 …
[HTML][HTML] 机器学习方法在高分子玻璃化研究中的应用
杨镇岳, 聂文建, 刘伦洋, 徐晓雷, 夏文杰, 徐文生 - 高分子学报, 2023 - gfzxb.org
… the present review discusses challenges and opportunities in the applications of machine
learning methods to polymer glass formation and provides a perspective on glass informatics. …
learning methods to polymer glass formation and provides a perspective on glass informatics. …
[HTML][HTML] 计算材料学在高分子材料领域的研究进展与发展趋势
侯冠一, 刘军, 张立群 - 高分子学报, 2023 - gfzxb.org
… /hardware technology has greatly enhanced the efficiency of large-scale parallel computing
… polymer electrolytes by machine learning assisted coarse-grained molecular dynamics. …
… polymer electrolytes by machine learning assisted coarse-grained molecular dynamics. …
C 坦恐. FEBRUARY 15, 1988
IN NONFLUIDIZED, P BOOM - search.proquest.com
… 40 years ago the same thing was said about using column … may be the only cost effective
means of separation. Remember… , York can determine parameters important for your separation …
means of separation. Remember… , York can determine parameters important for your separation …
[图书][B] 电子信息科学专业英语导读教程
郝红尉 - 2005 - books.google.com
… coarse grained have a small number of powerful configurable logic blocks, those with a
finer-grained … Effective utilization of a computing system is accomplished by creating a suitable …
finer-grained … Effective utilization of a computing system is accomplished by creating a suitable …
如何防止尾矿坝流态破坏
R Rodríguez, A Muñoz-Moreno… - Mine Water and the …, 2021 - Springer
… be fully saturated; (3) the effective stress due to static or dynamic … , and can be achieved using
a double drainage system, one … calculated using a coupled hydro-mechanical fine element …
a double drainage system, one … calculated using a coupled hydro-mechanical fine element …