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3 research outputs found
Effect of Protein Environment within Cytochrome P450cam Evaluated Using a Polarizable-Embedding QM/MM Method
Author
Altun A.
Altun A.
+48 more
Cho K.-B.
Chung L. W.
Davydov R.
de Visser S. P.
Denisov I. G.
Frähmcke J. S.
Gordon M. S.
Groves J. T.
Guengerich F. P.
Hajime Hirao
Harvey J. N.
Hirao H.
Hirao H.
Illingworth C. J. R.
Kitaura K.
Kumar D.
Li H.
Li H.
Meunier B.
Nandun M. Thellamurege
Omura T.
Ortiz de Montellano P. R.
Porro C. S.
Rittle J.
Russell S. T.
Schlichting I.
Schmidt M. W.
Schöneboom J. C.
Schöneboom J. C.
Schöneboom J. C.
Senn H. M.
Shaik S.
Shaik S.
Shaik S.
Sono M.
Thellamurege N.
Thellamurege N. M.
Thompson M. A.
von Hopffgarten M.
Vreven T.
Wang J.
Wanko M.
Warshel A.
Warshel A.
Welke K.
Wolter T.
Zhang Y.
Zhang Y.
Publication venue
'American Chemical Society (ACS)'
Publication date
Field of study
No full text
Crossref
Theoretical perspectives on carbocation chemistry from energy decomposition analysis
Author
A Alamiddine
AM Robbins
+25 more
B Chiavarino
BT Psciuk
C Liang
DH Aue
DJS Sandbeck
G Karir
G Velde te
GA Olah
I Dancini-Pontes
J Aleksić
JA Pople
K Lynch
K Morokuma
LA Curtiss
M Baranac-Stojanović
MW Schmidt
N Thellamurege
OA Stasyuk
P Kiprof
P Su
R Moss
RM Pontes
Rodrigo M. Pontes
RR Naredla
T Banu
Publication venue
'Springer Science and Business Media LLC'
Publication date
Field of study
No full text
Crossref
The 8-Silyloxyquinoline Scaffold as a Versatile Platform for the Sensitive Detection of Aqueous Fluoride
Author
Aboubakr H.
Aoba T.
+42 more
Arnold F. A.
Ashokkumar P.
Beck J. R.
Becke A. D.
Bozdemir O. A.
Cametti M.
Casida M. E.
Centers for Disease Control and Prevention
Chiba M.
Chiba M.
Cliff I. Stains
De Marco R.
Francl M. M.
Guo Z. Q.
Hirai M.
Hudnall T. W.
Hui Li
Irigoyen M. E.
Ke B.
Kim T. H.
Kloos H.
Kodali Y. R. R.
Korshoj L. E.
Krishnamachari K. A.
Li L.
Li Y.
Pearce D. A.
Rawlani S.
Rui Lai
Schmidt M. W.
Shults M. D.
Smith D. W.
Swamy P. C.
Szalewski D. A.
Thellamurege N. M.
Thellamurege N. M.
Turan I. S.
van den Hoop M. A. G. T.
Wade C. R.
Willard H. H.
Xinqi Zhou
Zhou Y.
Publication venue
'American Chemical Society (ACS)'
Publication date
Field of study
No full text
Crossref
No full text
