HpTonB(30-285) simulation Amber ff03ws
收藏NIAID Data Ecosystem2026-03-11 收录
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资源简介：
MD simulation of periplasmic part of TonB protein from Helicobacter Pylori HpTonB(30-285) with Amber ff03ws force field without additional ions. Trajectory contains the last 1000ns of the total 1171ns simulation. run1microsend.xtc (10 ps saving frequency), onlyPROTEIN.tpr, and confPROT.gro contain only protein. run6-8skip.xtc (10 ps saving frequency), run6.tpr and confEND.gro contain also solvent. Force field parameters are downloaded from https://github.com/bestlab/force_fields
创建时间：
2020-04-19
