I'm currently trying to use your force field to simulate aqueous IL systems and am a novice when it comes to GROMACS / MD in general. Would you be able to provide some guidance on how to get started?
Thank you very much for your help!
Best regards,
Pierre
I'm currently trying to use your force field to simulate aqueous IL systems and am a novice when it comes to GROMACS / MD in general. Would you be able to provide some guidance on how to get started?
Thank you very much for your help!
Best regards,
Pierre