All Questions
Tagged with polymers simulations
6
questions
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What will be the effect of density on relaxation time?
I am doing a Monte Carlo simulation of protein chains of various lengths.
I change the densities of the simulation box.
In my experiment, I found that density has no effect on relaxation time.
Do you ...
- 101
0
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Canonical partition function, simple model of 2D polymer
I am trying to simulate using monte-carlo method the behavior of a simple of polymer.
The model -
The polymer is made of N bars with length a , each bar can be placed in +a or -a relative to
the end ...
3
votes
1
answer
75
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Exploring potential landscape with Monte Carlo
I am using a Monte Carlo approach for studying folding of a polymer chain. The polymer may fold in many configurations, corresponding to local potential minima, studying which is what interests me (i....
- 60.3k
2
votes
1
answer
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Linking elastic moduli to shape fluctuations
I am simulating a polymer network shaped as a sphere. I would like to compute its elastic moduli (bulk and Young's, for example) not by their shear-strain definition but by looking at the fluctuations ...
- 1,225
3
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75
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Unexpected behaviour in numerical simulation of polymer
I noticed some strange behaviour when simulating the behaviour of a polymer subjected to an external pulling force at both ends, and would like to better understand its origin.
I used LAMMPS to ...
- 321
1
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1
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How can the presence of a solvent be included in a polymer bead-spring model?
I have a bead-spring model of a polymer melt and I would like to simulate what happens when a solvent is added to the system.
The most direct way to do this would be to add solvent particles into the ...
- 421