MolecularDynamic相关论文
纳米材料的生物相容性是人们关注的热点.氧化石墨烯是一种被广泛应用于生物医学的纳米材料,但其毒性不容忽视.本文从溶血率、红细......
Proton exchange membranes (PEMs) are a key material for proton exchange membrane fuel cells (PEM-FCs).Non-fluorinated hy......
In present work,we proposed two generic electrostaticmultipole-based force fields for protein coarse-grained(CG)simulati......
Molecular dynamics simulations were performed to study interactions between atomic hydrogen and silicon carbon.In presen......
Cytochrome P450(CYP)17A1 is a dual-function monooxygenase with a critical role in the synthesis or many human steroid ho......
Ebola virus (EBOV), a member of the filovirus family, is an enveloped negative-sense RNA virus that causes lethal infect......
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Structural basis of the changes in enzyme activity caused by deletion mutations in the β12-β13 loops
PP1, PP2A, and PP2B, three representative protein Ser/Thr phosphatases in PPPs, all contain typical catalytic cores ......
The surface diffusion of Pt dimers on Wulff polyhedral clusters with 586-12934 atoms was studied by the embedded atom me......
The impact of the atmospheric turbulence-development tendency on new particle formation:a common fin
A new mechanism of new particle formation(NPF)is investigated using comprehensive measurements of aerosol physicochemica......