1)  MM-PBSA
MM-PBSA
1.
Molecular Dynamics Simulation and MM-PBSA Free Energy Calculation of β-cyclodextrin and Estradiol;
β-环糊精和雌二醇的分子动力学模拟和MM-PBSA自由能计算
2.
The absolute binding free energy of FK506-binding proteins-12 with a potent inhibitor TST was calculated by molecular dynamics simulation with MM-PBSA method,and reasonable results were obtained.
文中采用分子动力学模拟取样,运用MM-PBSA方法计算了FKBP12-TST复合物的绝对结合自由能。
3.
In this paper,the binding free energy between HIV protease and inhibitor is calculated by molecular dynamics simulation with MM-PBSA method.
采用分子动力学模拟和MM-PBSA相结合方法计算了HIV蛋白酶和抑制剂的结合自由能。
2)  MM/PBSA
MM/PBSA
3)  MM-PBSA/GBSA
MM-PBSA/GBSA
4)  MM+
MM+
1.
Twenty three copper complexes are optimized with molecular mechanics MM++ method and semi-empirical PM3 method,and evaluated by comparing the coordination polyhedron as well as the length of coordination bond to those in crystal structures.
对比和评价了用分子力学MM+法和半经验PM3法模拟23个铜配合物分子几何结构的结果。
2.
To analyze the QSAR of 20 4T Nucleoside analogues, the MM++ geometry optimization and AMI quantum chemical indexes had been performed.
应用MM+分子力学法、量子化学AM1法计算了20个d4T核苷酸类似物的优势构象和电子结构,并用逐步回归分析方法寻找其量化指数与抗HIV(艾滋病)活性的关系。
3.
To analyze the QSAR of 2,3-Diaryl-1,3-thiazolidin-4-ones,the MM++geometry optimization and AM1 quantum chemical indexes had been performed.
应用MM+分子力学法、量子化学AM1法计算了31个2,3—二芳基—1,3—噻唑类似物的优势构象和电子结构,并用逐步回归分析方法寻找其量化指数与抗HIV(艾滋病)活性的关系。
5)  MM
MM
1.
Effect of substituting Mm with La on the performance of Co-free AB_5 type hydrogen storage alloy;
La替代Mm对无钴AB_5型贮氢合金性能的影响
2.
Combining UTD with MM for pattern prediction of the antenna in complex environment;
UTD结合MM计算复杂环境中天线的方向图
6)  QM/MM
QM/MM
参考词条
补充资料：1100mm×12.7mm大型冷弯型钢机组(汉口轧钢厂)


1100mm×12.7mm大型冷弯型钢机组(汉口轧钢厂)


一睽 1100mmx12.7mm大型冷弯型钢机组(汉口轧钢厂)
说明：补充资料仅用于学习参考，请勿用于其它任何用途。