Do you see any papers related to molecular dynamics simulation of metal nanoparticle and protein?
Hi how set "upper limit" "lower limit" in embedded-atom method (EAM) potential? Thank you
31 December 2016 9,893 1 View
I work on the interaction of CNT and proteins. The results show that the tertiary and secondary structure of proteins are changed (effected by CNT). VMD sequence viewer shows that the primary...
07 August 2014 5,880 2 View
I work with gromacs code on the protein carbon nanotubes interaction. I saw that when the protein becomes unfolded, the number of hydrogen bonds (in protein itself, not with water molecules)...
07 August 2014 5,623 2 View
I need to know the number of h bond per molecule for ethylene glycol.
05 June 2014 3,632 1 View
I see that in some papers the reported methanol-water in 300K shows a positive deviation from Raoult's law, but at low temperatures have negative deviation from Raoult's law. Does anyone have a...
10 November 2013 8,857 4 View
I need critical points as temperature,density and pressure of methanol with opls-aa force field.
10 November 2013 7,937 2 View
Is it possible to determine boiling point by lindemann index? I see some references, that work on melting point by lindemann index. But I need to determine boiling point by lindemann index.
10 November 2013 7,032 4 View
Molecular simulation and Raoult's law.
10 November 2013 1,584 5 View
I want to know that in methanol/water mixture from water rich to methanol rich, how change total hydrogen bonding in mixture? Less than pure water or not?
10 November 2013 4,015 6 View
I need to calculate heat capacity from r.m.s fluctuation energy that reported in OUTPUT. How to do it?
10 November 2013 9,638 5 View
Hi, I know that low molecular weight (MW) molecules generally tend to have higher mobility, while high molecular weight molecules tend to have lower mobility. However, in my experimental...
06 August 2024 1,495 2 View
Please can anyone support with the survey questions based on RQ measures and propose how to do it in FMCG industry and include as well the role of brand equity Thanks
06 August 2024 949 0 View
How to design VN primer to attach with universal reverse primer
05 August 2024 2,116 3 View
kindly reply me. Thanking you in advance.
05 August 2024 7,727 4 View
Is it possible to conduct a molecular dynamics simulation to see the effects of a specific carbohydrate on the structure of lipids (e.g., micelle structure)? I am a beginner in this field and plan...
03 August 2024 3,371 3 View
I am using a windows system, what software I should use for hydration shell analysis with molecular dynamics?
02 August 2024 3,143 4 View
Molecular docking software/ websites?
02 August 2024 8,704 7 View
Hello! I have this scale which had 10 items initially. I had to remove items 8 and 10 because they correlated negatively with the scale, and then I removed item 9 because Cronbach's alpha and...
01 August 2024 4,606 7 View
I am currently working on a project involving liposomes and need to determine the maximum volume of siRNA that can be added to a 2.5 mL liposome solution with a total lipid concentration of 10...
30 July 2024 6,420 1 View
In STATISTICA 13.3, I used the Experimental Design Builder under the Design of Experiments tab to generate a design matrix for an asymmetrical factorial design (1443) with 12 experiments. However,...
29 July 2024 4,155 2 View