Computational alanine scanning with linear scaling semiempirical quantum mechanical methods.
about
XModeScore: a novel method for accurate protonation/tautomer-state determination using quantum-mechanically driven macromolecular X-ray crystallographic refinement.ECMIS: computational approach for the identification of hotspots at protein-protein interfaces.QSAR-assisted design of an environmental catalyst for enhanced estrogen remediation.Accurate macromolecular crystallographic refinement: incorporation of the linear scaling, semiempirical quantum-mechanics program DivCon into the PHENIX refinement packageApplying physics-based scoring to calculate free energies of binding for single amino acid mutations in protein-protein complexesInsight into the modified Ibalizumab-human CD4 receptor interactions: using a computational binding free energy approach.KFC2: a knowledge-based hot spot prediction method based on interface solvation, atomic density, and plasticity features.
P2860
Q27316736-2691739E-229F-4075-9E0A-CC27448CC9B5Q30366872-C0A5049B-533C-4CA2-8B38-0D478645D379Q30429911-4F8AC2B1-BFC0-408D-B6E1-7D2586102809Q30577677-5E01FB73-6341-4958-B0AD-23F9D8CE36F5Q35067889-38E875D8-A491-4227-BE6C-4B5D9F3972AEQ42182937-713CBB92-5262-4EAB-960D-4181DCFCBB00Q51550360-EB2F29EB-631F-4194-9F62-FE65EDDCC2EC
P2860
Computational alanine scanning with linear scaling semiempirical quantum mechanical methods.
description
2010 nî lūn-bûn
@nan
2010 թուականի Օգոստոսին հրատարակուած գիտական յօդուած
@hyw
2010 թվականի օգոստոսին հրատարակված գիտական հոդված
@hy
2010年の論文
@ja
2010年論文
@yue
2010年論文
@zh-hant
2010年論文
@zh-hk
2010年論文
@zh-mo
2010年論文
@zh-tw
2010年论文
@wuu
name
Computational alanine scanning ...... al quantum mechanical methods.
@ast
Computational alanine scanning ...... al quantum mechanical methods.
@en
Computational alanine scanning ...... al quantum mechanical methods.
@nl
type
label
Computational alanine scanning ...... al quantum mechanical methods.
@ast
Computational alanine scanning ...... al quantum mechanical methods.
@en
Computational alanine scanning ...... al quantum mechanical methods.
@nl
prefLabel
Computational alanine scanning ...... al quantum mechanical methods.
@ast
Computational alanine scanning ...... al quantum mechanical methods.
@en
Computational alanine scanning ...... al quantum mechanical methods.
@nl
P2093
P2860
P356
P1433
P1476
Computational alanine scanning ...... al quantum mechanical methods.
@en
P2093
Christine Humblet
David J Diller
Lance M Westerhoff
Xiaohua Zhang
P2860
P304
P356
10.1002/PROT.22745
P407
P577
2010-08-01T00:00:00Z