Loại tài liệu:    Chỉ tìm trong: 
61-70 trong số 164 kết quả
Molecular dynamics modeling of different conformations of beta-glucan, molecular docking with dectin-1, and the effects on macrophages
Tác giả: Rui Huo, Wuhanqimuge, Meili Zhang, Minjun Sun, Ying Miao
Xuất bản: Netherlands: International journal of biological macromolecules , 2025
Bộ sưu tập: NCBI
ddc:  523.019
 
Molecular Dynamics Simulation of Structural Assembly and Hydration of Hyaluronic Acid in Salt Aqueous Buffer
Tác giả: Saranya Vasudevan, Sandipan Chattaraj, Alessandro Enrico, Francesco Silvio Pasqualini
Xuất bản: United States: Langmuir : the ACS journal of surfaces and colloids , 2025
Bộ sưu tập: NCBI
ddc:  004.678
 
Molecular Dynamics Simulation of Structural Assembly and Hydration of Hyaluronic Acid in Salt Aqueous Buffer
Tác giả: Saranya Vasudevan, Sandipan Chattaraj, Alessandro Enrico, Francesco Silvio Pasqualini
Xuất bản: United States: Langmuir : the ACS journal of surfaces and colloids , 2025
Bộ sưu tập: NCBI
ddc:  523.019
 
Revertant mutation V48G alters conformational dynamics of highly drug resistant HIV protease PRS17 [electronic resource]
Tác giả:
Xuất bản: Washington, D.C. : Oak Ridge, Tenn: United States. Dept. of Energy. Office of Science ; Distributed by the Office of Scientific and Technical Information, U.S. Dept. of Energy , 2021
Bộ sưu tập: Báo, Tạp chí
ddc:  616.907
 
Machine learning of molecular dynamics simulations provides insights into modulation of viral capsid assembly
Tác giả: Anna Pavlova, Zixing Fan, Diane L Lynch, James C Gumbart
Xuất bản: United States: bioRxiv : the preprint server for biology , 2025
Bộ sưu tập: NCBI
ddc:  006.31
 
Machine learning-driven molecular dynamics unveils a bulk phase transformation driving ammonia synthesis on barium hydride
Tác giả: Axel Tosello Gardini, Umberto Raucci, Michele Parrinello
Xuất bản: England: Nature communications , 2025
Bộ sưu tập: NCBI
ddc:  006.31
 
Advancing nonadiabatic molecular dynamics simulations in solids with E(3) equivariant deep neural hamiltonians
Tác giả: Changwei Zhang, Weibin Chu, Xin-Gao Gong, Zhenggang Lan, Oleg V Prezhdo, Xinming Qin, Honghui Shang, Zhi-Guo Tao, Hongjun Xiang, Yang Zhong
Xuất bản: England: Nature communications , 2025
Bộ sưu tập: NCBI
ddc:  252.6
 
Molecular screening and dynamics simulation reveal potential phytocompounds in Swertia chirayita targeting the UspA1 protein of Moraxella catarrhalis for COPD therapy
Tác giả: Md Moin Uddin, Rafsan Abir, Asif Ahsan, Mohammad Shah Alam, Md Faisal Amin, Abdul Barik, Md Shydhur Rahman Chowdhury, M Nazmul Hoque, Md Arju Hossain, Md Tanvir Hossain, Md Arif Hossen, Md Habibur Rahman
Xuất bản: United States: PloS one , 2025
Bộ sưu tập: NCBI
ddc:  664.34
 
Design, synthesis and molecular dynamics simulations of thiazole-based hydrazones targeting MDA-MB-231 breast cancer cells
Tác giả: Shankar G Alegaon, Shankar Gharge, Vijay M Kumbar, Manjula I Kambi, Sunidhi Patil, Sachin Gudasi, Shriram D Ranade, Niteen R Sutar, Rohini S Kavalapure, Pravin C Mhaske, Deepa R Mane, Shahana Shahpuri
Xuất bản: United States: Bioorganic chemistry , 2025
Bộ sưu tập: NCBI
ddc:  296.1121
 
Experimental investigation and molecular dynamics simulation for the effect of a novel Gemini cationic surfactant on gas coal wettability
Tác giả: Gang Zhou, Kai Huang, Xin Jiang, He Yang, Xi Chen, Jingxu Chen, Guochao Yan, Guoqing Zhang, Qi Wang
Xuất bản: England: Journal of environmental management , 2025
Bộ sưu tập: NCBI
ddc:  001.434
 

Truy cập nhanh danh mục