Bayesian Model Averaging for Ensemble-Based Estimates of Solvation-Free Energies.

about

Bayesian Model Averaging for Ensemble-Based Estimates of Solvation-Free Energies.

Item

http://www.wikidata.org/entity/Q38783032

description

2016 nî lūn-bûn

@nan

2016年の論文

@ja

2016年論文

@yue

2016年論文

@zh-hant

2016年論文

@zh-hk

2016年論文

@zh-mo

2016年論文

@zh-tw

2016年论文

@wuu

2016年论文

@zh

2016年论文

@zh-cn

name

Bayesian Model Averaging for Ensemble-Based Estimates of Solvation-Free Energies.

@en

type

Item

label

Bayesian Model Averaging for Ensemble-Based Estimates of Solvation-Free Energies.

@en

prefLabel

Bayesian Model Averaging for Ensemble-Based Estimates of Solvation-Free Energies.

@en

P1476

Bayesian Model Averaging for Ensemble-Based Estimates of Solvation-Free Energies.

@en

P2093

David L Mobley

http://www.w3.org/2001/XMLSchema#string

Luke J Gosink

http://www.w3.org/2001/XMLSchema#string

Paul D Whitney

http://www.w3.org/2001/XMLSchema#string

Sarah M Reehl

http://www.w3.org/2001/XMLSchema#string

P2860

Solvation energy in protein folding and binding

Development and testing of a general amber force field

Classical electrostatics in biology and chemistry

On the nonpolar hydration free energy of proteins: surface area and continuum solvent models for the solute-solvent interaction energy.

Bayesian model aggregation for ensemble-based estimates of protein pKa values.

Exhaustive docking and solvated interaction energy scoring: lessons learned from the SAMPL4 challenge.

Atomic hydration potentials using a Monte Carlo Reference State (MCRS) for protein solvation modeling.

Prediction of free energies of hydration with COSMO-RS on the SAMPL4 data set.

Model selection in medical research: a simulation study comparing Bayesian model averaging and stepwise regression.

Predicting hydration free energies of polychlorinated aromatic compounds from the SAMPL-3 data set with FiSH and LIE models.

P304

3458-3472

http://www.w3.org/2001/XMLSchema#string

P31

scholarly article

P356

10.1021/ACS.JPCB.6B09198

http://www.w3.org/2001/XMLSchema#string

P407

English

P433

http://www.w3.org/2001/XMLSchema#string

P478

121

http://www.w3.org/2001/XMLSchema#string

P50

Nathan Baker

Christopher Overall

P577

2017-01-04T00:00:00Z

http://www.w3.org/2001/XMLSchema#dateTime

P698

27966363

http://www.w3.org/2001/XMLSchema#string

P818

1609.03257

http://www.w3.org/2001/XMLSchema#string

P932

5398953

http://www.w3.org/2001/XMLSchema#string