比较分子力场分析法,CoMFA英语短句,例句大全

比较分子力场分析法,CoMFA
CoMFA比较分子力场分析方法
1.Methods A 3D-QSAR model of thirty-four SSRIs was established by the comparative molecular field analysis(CoMFA).方法通过确定34个茚胺类化合物分子的药效构象,与模板分子进行分子叠加,利用比较分子力场分析方法(CoMFA),建立了一个选择性SSRIs的三维定量构效模型。
2.METHODS To quantitively disclose the relationship between structure and actitivety of a series of selective serotonin reuptake inhibitors(SSRIs) for 3-Phenyl -1-indan-amines,and build a three dimensional Quantitative structure activity relationship(3D-QSAR) model for the design of novel potent drugs by the comparative molecular field analysis(CoMFA).方法:通过比较分子力场分析方法(CoMFA),建立有较高的预测能力的苯茚胺类似物抗抑郁活性的三维定量构效模型,研究其结构与活性间的关系,指导设计并优化合成出新的化合物,然后用小鼠悬尾实验进行初步的抗抑郁药理活性的筛选,得到具有抗抑郁活性的新的苯茚胺类似物。
3.Specifically,CDK2-QSAR(quantitative structure-activity relationship) and CDK4-QSSR(quantitative structure-selectivity relationship) CoMFA(comparative molecular field analysis) studies were carried out on indolocarbazole derivatives as CDK inhibitors.针对吲哚咔唑类CDK抑制剂,我们采用比较分子力场分析方法(CoMFA)建立了CDK2-QSAR(quantitative structure-activity relationship)和CDK4-QSSR(quantitative structure-selectivity relationship)模型。
3)CoMFA比较分子力场法
1.It is our aim to establish the CoMFA models of the ent-kauranoids from Isodon xerophilus and guide the design for new anti-cancer drugs.应用比较分子力场法(COMFA)研究了一系列旱生香茶菜二萜化合物对人红细胞白血病(K562)、人早幼粒白血病(HL60)、人胃腺癌(MKN28)和人结肠癌(HCT)细胞体外抗肿瘤活性进行了三维定量构效关系的初步研究,其结果将为香茶菜二萜的结构修饰和简化,先导化合物的发现提供理论依据。
4)comparative molecular field analysis(CoMFA)比较分子力场分析(CoMFA)
5)CoMFA比较分子力场分析
1.Comparative Molecular Field Analysis (CoMFA) of α_1-Adrenocepter Antagonist DDPH and Its Analogues;α_1-AR拮抗剂DDPH类似物的比较分子力场分析
2.The three-dimensional quantitative structure-activity relationships of N, N-dimethyl-2-bromo-2-phenylethylamine were systematically studied by using comparative molecular field analysis (CoMFA) and comparative molecular similarity indices analysis (CoMSIA).用比较分子力场分析(CoMFA)法和比较分子相似性指数分析(CoMSIA)法,建立N,N-二甲基-2-溴苯乙胺类化合物的3D-QSAR模型。
3.In this paper, the structure toxicity/activity relationships of 26 chlorophenol compounds are inves(?)igated by comparative molecular field analysis (CoMFA).通过比较分子力场分析(CoMFA)法建立标题化合物对发光菌和浮萍活性的三维定量结构-活性关系(3D-QSAR)模型。
6)comparative molecular field analysis比较分子力场分析
1.The three-dimensional quantitative structure-activity relationship between the structure of 22 ti- tle compounds and their retardant activity to rat has been set up by comparative molecular field analysis (CoMFA).通过比较分子力场分析(CoMFA)方法,建立了22个标题化合物对大鼠阻断活性的三维定量结构-活性关系(3D-QSAR)模型。
2.Methods A 3D-QSAR model of thirty-one nonsteroidal progesterone receptor agonists 5-benzylidene-l, 2-dihydro-5H-chromeno[3,4-f] quinolines was established by comparative molecular field analysis (CoMFA) method.方法利用比较分子力场分析方法,建立31个非甾体类5-亚苄基类取代-1,2-二氢-5H-苯并吡喃并[3,4-f]喹啉人体内孕酮受体激动剂三维定量构效模型。
3.Then the model of comparative molecular field analysis (CoMFA) was established by global lowest energy conformation.十站:从报道的2一叫咪酮类＊＊＊F受体酪氨酸激酶抑制剂中选取35个化合物,采用分子全局最低能量构象以最小二乘匹配法叠合分子建立比较分子力场分析(CoMFA)模型。