QM/MM molecular dynamics studies of metal binding proteins
about
Ab initio dynamics of the cytochrome P450 hydroxylation reactionEvaluation of potential flavonoid inhibitors of glyoxalase-I based on virtual screening and in vitro studies.An omics perspective to the molecular mechanisms of anticancer metallo-drugs in the computational microscope era.Atomistic-level portrayal of drug-DNA Interplay: a history of courtships and meetings revealed by molecular simulations.Quantum Mechanics/Molecular Mechanics Modeling of Enzymatic Processes: Caveats and Breakthroughs.Hydrogenase Enzymes and Their Synthetic Models: The Role of Metal Hydrides.Histidine residues are important for preserving the structure and heme binding to the C. elegans HRG-3 heme-trafficking protein.Cooperative motion of a key positively charged residue and metal ions for DNA replication catalyzed by human DNA Polymerase-η.Quantum mechanics implementation in drug-design workflows: does it really help?Quantum mechanics/coarse-grained molecular mechanics (QM/CG-MM).Structural Origin of Metal Specificity in Isatin Hydrolase from Labrenzia aggregata Investigated by Computer Simulations.
P2860
Q35201103-845EE562-A55A-4FDB-9737-5926AE992AE8Q35673589-17939BDB-C727-4AC1-9BA6-E91534992790Q36398911-5647B242-CDFE-40C0-9FE2-EB0EF88D5289Q38237566-158F60EF-EFCC-4B70-98BF-3A10CCDF13FFQ38676840-BA56B958-8160-4E9C-886D-5DD963774E73Q38880043-D5B57629-1FC3-425B-8AAA-601A1128EE92Q38946626-EE0481A3-A9BC-4755-AB9D-0EC1C9E23AAFQ39951181-1BCF2D92-736B-455D-8568-2FFE9212C396Q41633463-FC87A528-9B1B-4110-9497-82B0371DA682Q47227642-8C9346D0-BFFD-4884-973F-0DB9D9B42B15Q47754291-A24AE8DA-EFFB-4105-A2BA-A7AA4B7595DB
P2860
QM/MM molecular dynamics studies of metal binding proteins
description
2014 nî lūn-bûn
@nan
2014 թուականի Յուլիսին հրատարակուած գիտական յօդուած
@hyw
2014 թվականի հուլիսին հրատարակված գիտական հոդված
@hy
2014年の論文
@ja
2014年論文
@yue
2014年論文
@zh-hant
2014年論文
@zh-hk
2014年論文
@zh-mo
2014年論文
@zh-tw
2014年论文
@wuu
name
QM/MM molecular dynamics studies of metal binding proteins
@ast
QM/MM molecular dynamics studies of metal binding proteins
@en
QM/MM molecular dynamics studies of metal binding proteins
@nl
type
label
QM/MM molecular dynamics studies of metal binding proteins
@ast
QM/MM molecular dynamics studies of metal binding proteins
@en
QM/MM molecular dynamics studies of metal binding proteins
@nl
prefLabel
QM/MM molecular dynamics studies of metal binding proteins
@ast
QM/MM molecular dynamics studies of metal binding proteins
@en
QM/MM molecular dynamics studies of metal binding proteins
@nl
P2860
P921
P356
P1433
P1476
QM/MM molecular dynamics studies of metal binding proteins
@en
P2093
Alessandra Magistrato
Pietro Vidossich
P2860
P304
P356
10.3390/BIOM4030616
P407
P577
2014-07-08T00:00:00Z