Absolute hydration free energies of blocked amino acids: implications for protein solvation and stability.
about
Predicting hydration free energies with a hybrid QM/MM approach: an evaluation of implicit and explicit solvation models in SAMPL4SCMMTP: identifying and characterizing membrane transport proteins using propensity scores of dipeptides.Solvation free energy of the peptide group: its model dependence and implications for the additive-transfer free-energy model of protein stabilityCharacterizing hydrophobicity of amino acid side chains in a protein environment via measuring contact angle of a water nanodroplet on planar peptide network.Importance of Hydrophilic Hydration and Intramolecular Interactions in the Thermodynamics of Helix-Coil Transition and Helix-Helix Assembly in a Deca-Alanine Peptide.Multiscale Free Energy Simulations: An Efficient Method for Connecting Classical MD Simulations to QM or QM/MM Free Energies Using Non-Boltzmann Bennett Reweighting SchemesConditional solvation thermodynamics of isoleucine in model peptides and the limitations of the group-transfer modelSolvation Thermodynamics of Oligoglycine with Respect to Chain Length and Flexibility.Solvation thermodynamics of amino acid side chains on a short peptide backbone.An efficient protocol for obtaining accurate hydration free energies using quantum chemistry and reweighting from molecular dynamics simulationsPeptide Solubility Limits: Backbone and Side-Chain Interactions.BAR-based optimum adaptive sampling regime for variance minimization in alchemical transformation.Hydration Free Energies in the FreeSolv Database Calculated with Polarized Iterative Hirshfeld Charges
P2860
Q34351290-D023EEDF-8E62-46DE-8772-C4D3CF31BCB2Q35871507-D82947B6-B5A8-4D1A-8562-C065C43EA4F1Q37204340-6EA22BF7-575C-4449-9AD8-F514D0669FF3Q37469482-376650A3-90CD-461E-B678-E01A642A9B47Q37659025-A1EB5618-3A2A-4181-B531-D44111FEF560Q37701502-BEC075C8-FC1F-4AF9-99BA-58954AA408D2Q37714202-A4965A0C-7524-446D-9ED3-A2C6C5F1B241Q40960252-929062EB-0754-4D4E-9A8D-F13687A18D40Q41068263-A8754F32-142C-43FB-8582-6759BE3E8C18Q42382077-75D67F02-87D8-4C94-9E17-420DF2225382Q47694416-E54C80BF-FCBA-4BAC-BE76-E825D841F378Q48788986-CC1FF3F2-B81D-40FC-8B0A-706CBBBD7FE0Q58778566-F070CEF1-A2A5-4D77-B6D1-9D947B0AF3D8
P2860
Absolute hydration free energies of blocked amino acids: implications for protein solvation and stability.
description
2013 nî lūn-bûn
@nan
2013年の論文
@ja
2013年論文
@yue
2013年論文
@zh-hant
2013年論文
@zh-hk
2013年論文
@zh-mo
2013年論文
@zh-tw
2013年论文
@wuu
2013年论文
@zh
2013年论文
@zh-cn
name
Absolute hydration free energi ...... otein solvation and stability.
@ast
Absolute hydration free energi ...... otein solvation and stability.
@en
type
label
Absolute hydration free energi ...... otein solvation and stability.
@ast
Absolute hydration free energi ...... otein solvation and stability.
@en
prefLabel
Absolute hydration free energi ...... otein solvation and stability.
@ast
Absolute hydration free energi ...... otein solvation and stability.
@en
P2860
P1433
P1476
Absolute hydration free energi ...... otein solvation and stability.
@en
P2093
Stefan Bruckner
P2860
P304
P356
10.1016/J.BPJ.2012.12.008
P407
P577
2013-01-01T00:00:00Z