Molecular Dynamics Simulations (100 nanoseconds) of PD-1 in complex with GY-14 antibody at 311K (38°C). Includes PDB files obtained every 50 ns.

DataONE2023-10-13 更新120

Diaspartate and diglutamate + CaCO3 dimer

分子相互作用模拟

生物矿化机制

Structures of calcium diaspartate+calcium carbonate dimer and calcium diglutamate+calcium carbonate dimer optimized in the gas phase at the RI-MP2/SVP level of theory. This structures are supplementar

Figshare2016-01-19 更新10

PDB: 1S78, Erb (HER-2) in complex with pertuzumab (310K, 37°C, 100 ns)

分子相互作用模拟

药物设计

Molecular Dynamics Simulations (100 nanoseconds) of Erb (HER-2) in complex with pertuzumab at 310K (37°C). Includes PDB files obtained every 50 ns.

NIAID Data Ecosystem00

PDB: 3PP4, Cd20 in complex with obinutuzumab (310K, 37°C, 100 ns)

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PDB: 3PP4, Cd20 in complex with obinutuzumab (310K, 37°C, 100 ns)

资源简介：

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