Structural modeling and MD simulation files for the Ca²⁺-bound calmodulin (CaM)-LL-37 fusion protein
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资源简介：
mdp_files.zip: Archive containing the .mdp files used for the GROMACS MD simulations. CaM_LL_Ca_AF3.pdb: Predicted structure generated using AlphaFold3. step4.1_equilibration.gro: Initial structure used for the MD production run. step5_0_noPBC.xtc: Trajectory file from the 500-ns MD production run after PBC correction.
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Zenodo创建时间：
2026-06-10
