Ilia Anisa

5 Questions 17 Answers 0 Followers

Questions related from Ilia Anisa

Can anybody help me regarding the mathematical study of plant extract?

why we need to use cumulative yield while plotting the graph of yield vs time instead of using non-cumulative? since for thermal labile compounds, the degradation (reducing of yield) observe for...

12 December 2014 2,850 6 View

How do I perform a curve fitting if the model is in pde form with neumann boundary conditions?

if I have model in partial differential equation with Neumann boundary conditions, how can i do the curve-fitting with experimental data? I've planned to use optimization toolbox with lsqcurvefit...

12 December 2014 5,957 16 View

How can temperature setting differ while running NVT from NPT?

i am facing a problem while running MD simulation of my system. i set the ensemble as NPT to identify the density. Then I changed to NVT with new density with same desired temperature. I found...

05 May 2014 4,976 2 View

Is there any difference for inputting the data of torsional energy if I use degree instead of radian?

I simulated my sample but I just recognized that I input the data in degree unit. Or do I need to change into radian and run again?

05 May 2014 432 2 View

How can pressure setting be adjusted in an MD simulation if in the real experimental work we ran at high pressure?

In one journal I read the real pressure was 25MPa, but in MD simulation, they applied 18.6MPa only. In my study, I used 10MPa but I don't know how to predict the pressure in MD simulation?...

04 April 2014 2,151 5 View