Further along the Road Less Traveled: AMBER ff15ipq, an Original Protein Force Field Built on a Self-Consistent Physical Model
about
Perspective: Echoes in 2D-Raman-THz spectroscopy.Reparametrization of Protein Force Field Nonbonded Interactions Guided by Osmotic Coefficient Measurements from Molecular Dynamics Simulations.D4 dopamine receptor high-resolution structures enable the discovery of selective agonists.Computational Modeling of the Hsp90 Interactions with Cochaperones and Small-Molecule Inhibitors.Links between the charge model and bonded parameter force constants in biomolecular force fields.Force field development and simulations of intrinsically disordered proteins.Evaluating amber force fields using computed NMR chemical shifts.Reparameterization of Solute-Solute Interactions for Amino Acid-Sugar Systems Using Isopiestic Osmotic Pressure Molecular Dynamics Simulations.How well do force fields capture the strength of salt bridges in proteins?Many-body effect determines the selectivity for Ca and Mg in proteinsRotational Dynamics of Proteins from Spin Relaxation Times and Molecular Dynamics SimulationsHydration Free Energies in the FreeSolv Database Calculated with Polarized Iterative Hirshfeld Charges
P2860
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P2860
Further along the Road Less Traveled: AMBER ff15ipq, an Original Protein Force Field Built on a Self-Consistent Physical Model
description
2016 nî lūn-bûn
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2016年の論文
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2016年学术文章
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2016年学术文章
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2016年学术文章
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2016年学术文章
@zh-my
2016年学术文章
@zh-sg
2016年學術文章
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2016年學術文章
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2016年學術文章
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name
Further along the Road Less Tr ...... Self-Consistent Physical Model
@ast
Further along the Road Less Tr ...... Self-Consistent Physical Model
@en
type
label
Further along the Road Less Tr ...... Self-Consistent Physical Model
@ast
Further along the Road Less Tr ...... Self-Consistent Physical Model
@en
prefLabel
Further along the Road Less Tr ...... Self-Consistent Physical Model
@ast
Further along the Road Less Tr ...... Self-Consistent Physical Model
@en
P2093
P2860
P356
P1476
Further along the Road Less Tr ...... Self-Consistent Physical Model
@en
P2093
Angela M Gronenborn
David A Case
David S Cerutti
Karl T Debiec
Lewis R Baker
Lillian T Chong
P2860
P304
P356
10.1021/ACS.JCTC.6B00567
P577
2016-07-11T00:00:00Z