Accurate calculation of mutational effects on the thermodynamics of inhibitor binding to p38α MAP kinase: a combined computational and experimental study
about
Assessing the performance of MM/PBSA and MM/GBSA methods. 4. Accuracies of MM/PBSA and MM/GBSA methodologies evaluated by various simulation protocols using PDBbind data set.Protein design algorithms predict viable resistance to an experimental antifolateReview structure- and dynamics-based computational design of anticancer drugs.Reparametrization of Protein Force Field Nonbonded Interactions Guided by Osmotic Coefficient Measurements from Molecular Dynamics Simulations.Using the fast fourier transform in binding free energy calculations.Absolute Binding Free Energies between T4 Lysozyme and 141 Small Molecules: Calculations Based on Multiple Rigid Receptor Configurations.Implicit ligand theory for relative binding free energies.
P2860
Q30835329-FC603C76-6F49-42F2-B2ED-E4CE69486B8FQ35031482-E5967CC4-D003-4C74-8AC4-21FD98CCE354Q38589320-FE249810-78CD-4B64-81DF-09CD979220D5Q41250855-147EB05D-C364-488A-8B2C-AE1CC7D8133AQ47261847-B2BC7F93-4CCF-4BB9-9CCD-D3A058935611Q48063202-5438FA92-AC05-4C3E-BFF5-C88540E95B07Q52653810-BDF5B334-D68F-4AA4-9B2D-D94F650AF946
P2860
Accurate calculation of mutational effects on the thermodynamics of inhibitor binding to p38α MAP kinase: a combined computational and experimental study
description
article científic
@ca
article scientifique
@fr
articolo scientifico
@it
artigo científico
@pt
bilimsel makale
@tr
scientific article published on July 2013
@en
vedecký článok
@sk
vetenskaplig artikel
@sv
videnskabelig artikel
@da
vědecký článek
@cs
name
Accurate calculation of mutati ...... ational and experimental study
@en
Accurate calculation of mutati ...... tional and experimental study.
@nl
type
label
Accurate calculation of mutati ...... ational and experimental study
@en
Accurate calculation of mutati ...... tional and experimental study.
@nl
prefLabel
Accurate calculation of mutati ...... ational and experimental study
@en
Accurate calculation of mutati ...... tional and experimental study.
@nl
P2860
P356
P1476
Accurate calculation of mutati ...... ational and experimental study
@en
P2093
Adrian H Elcock
Sue M Travis
P2860
P304
P356
10.1021/CT400104X
P50
P577
2013-07-01T00:00:00Z