A carregar...
Free Energy, Enthalpy and Entropy from Implicit Solvent End-Point Simulations
Free energy is the key quantity to describe the thermodynamics of biological systems. In this perspective we consider the calculation of free energy, enthalpy and entropy from end-point molecular dynamics simulations. Since the enthalpy may be calculated as the ensemble average over equilibrated sim...
Na minha lista:
| Publicado no: | Front Mol Biosci |
|---|---|
| Main Authors: | , , |
| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
Frontiers Media S.A.
2018
|
| Assuntos: | |
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC5809407/ https://ncbi.nlm.nih.gov/pubmed/29473043 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3389/fmolb.2018.00011 |
| Tags: |
Adicionar Tag
Sem tags, seja o primeiro a adicionar uma tag!
|