For predicting drug release from polymeric nanoparticles, consider using tools on nanoHUB like "NanoParticle Simulator" or mathematical models such as Korsmeyer-Peppas. Additionally, software like GROMACS for molecular dynamics simulations or commercial options like COMSOL can provide valuable insights into drug delivery systems.

Abdelhak Maghchiche thank you for your response. I would be grateful if you could provide additional guidance.

Specifically, I am aiming to test a range of parameters to determine the system that best aligns with the desired characteristics of my nanoparticles as carriers for a therapeutic protein. I am particularly interested in varying the mass and molecular weight of the copolymer, as well as the mass of the encapsulated protein, and using in silico simulations to predict the release profile while maintaining a spherical shape with a diameter of 150-200 nm.

I currently lack experimental data, as I would like to complete these simulations prior to ordering the copolymer materials.

Is there a tool available that would support these objectives? As I am new to this field, any guidance would be invaluable.

Thank you in advance for your time and assistance.

For predicting drug release from polymeric nanoparticles, you can explore tools like:

All of which can we easily done at mdsim360.com, a new platform that lets you run MD simulations entirely online without local installation.