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Conformational relaxations of human serum albumin studied by molecular dynamics simulations with pressure jumps
Aim. In this work we developed a novel technique of obtaining the spectrum of conformational relaxations in a solvated protein using non-equilibrium molecular dynamics simulation. Methods. Structural relaxations in the protein are initiated by the abrupt jump of pressure in the NPT simulations. The...
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| Main Authors: | , |
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| Format: | Article |
| Language: | English |
| Published: |
Інститут молекулярної біології і генетики НАН України
2012
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| Series: | Вiopolymers and Cell |
| Subjects: | |
| Online Access: | http://dspace.nbuv.gov.ua/handle/123456789/156856 |
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