Exploring Tubulin-Paclitaxel Binding Modes through Extensive Molecular Dynamics Simulations
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下载链接：
https://zenodo.org/record/11312331
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资源简介：
Molecular dynamics trajectories and reference structures:
3j6g.zip
6ew0.zip
5syf.zip
5syf_restr.zip - the 5syf system with positional restraints
topologies.zip - molecular dynamics topologies (including paclitaxel, GDP/GTP), starting conformations, and MD parameters (mdp files)
clusters.zip - representative structures of identified clusters (centeral structure, structure with minimal energy, structure with the energy decomposition in the B-factor)
创建时间：
2024-06-24
