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:microscope: OpenMM scripts for polarisable molecular dynamics with the AMOEBA force field

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AMOEBA POPE simulation

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Hello, First of all I'd like to thank you for creating the AMOEBA force field files for the POPE lipids. I have been trying to run a pure POPE bilayer...

batukav avatar batukav

AMOEBA for small molecule from Tinker poltype2

Hi, First of all thanks for providing the thinker2openmm code for amoeba force field. I am very new to the amoeba force field. I am using your code to covert...

pradipchm avatar pradipchm

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:microscope: OpenMM scripts for polarisable molecular dynamics with the AMOEBA force field

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