In its simplest form, MD is based on Newtonian mechanics, solving the second order differential equations describing Newton's law of motion (1)mir¨i=Fi≡−∇riE, where mi and ri represent the mass and position of atom i, respectively, and E describes the potential energy of all the ...
The nanoscale heat and mass transport phenomena play important roles on the applications of nanotechnologies with great attention to its differences from t... G Nagayama,M Kawagoe,T Tsuruta - 微纳系统集成及其商业化应用国际学术会议 被引量: 9发表: 2007年 Molecular dynamics simulation of thermal ener...
Symmetry-switching molecular Fe(O2)n(+) clusters. Experimental and theoretical studies based on mass spectrometry, collision-induced dissociation, and ab initio calculations are performed on the formation ... G Mpourmpakis,M Velegrakis,C Mihesan,... - 《Journal of Physical Chemistry A》 被引...
The compound 5 was characterized by 1H, 13C and mass spectroscopic analyses. Also, its structure was further confirmed by X-ray single crystal analysis. From Hirshfeld calculations, it was clear that the H…H (51.1 %), H…C (21.6 %), O…H (18.9 %) and N…H (6.3 %) interactions ...
7. Objective:To establish a method to determine relative molecular mass and distribution of hydroxyethyl starch 130/0.4 and sodium chloride injection by size exclusion chromatography. 目的:建立凝胶色谱法由多角度激光光散射检测器和示差折光检测器联用测定羟乙基淀粉130/0.4氯化钠注射液相对分子质量及分布的方...
Kimble BJ, Maxwell JR, Philp RP, Eglinton G (1974) Identification of steranes and triterpanes in geolipid extracts by high-resolution gas chromatography and mass spectrometry. Chem Geol 14:173 CAS Google Scholar Pearson MJ, Obaje NG (1999) Onocerane and other triterpenoids in Late Cretaceou...
运用分子动力学方法研究了不同He浓度和不同级联能下含He的α-Fe低温时的位移级联过程.模拟的主要撞击原子(PKA)的能量(EP)(即级联能)从500eV变化到5keV,辐照温 度为100... Yang Li,Zu XiaoTao,Xiao HaiYan,... - 《物理学报》 被引量: 44发表: 2005年 Effect of mass of the primary knock-on atom ...
“Oxidative DNA damage estimated by 8-hydroxydeoxyguanosine excretion in humans: influence of smoking, gender and body mass index”. Carcinogenesis (London) 1992; 13:2241–2247. Article CAS Google Scholar Lok E, Scott FW, Mongeau R, Nera EA, Malcolm S and Clayson DB. “Caloric restriction...
Hypergravity and microgravity exhibited reversal effects on the bone and muscle mass in mice Tsukasa Tominari Ryota Ichimaru Masaki Inada ArticleOpen Access29 Apr 2019 Scientific Reports Development of a quantitative method to measure EV uptake Víctor Toribio Sara Morales María Yáñez-Mó ...
multivariate analysis were the commonly reported biomarkers (ER, PR, HER2, and Ki-67), age, tumour size and grade, age at diagnosis, lymph node stage, histological grade, body mass index (BMI), chemotherapy regimens, chemotherapy cycles, and other biomarkers and genetic variations unique to ...