17th Jun 2014
894_2014_2319_Figa_HTML

Elucidating the structural basis of diphenyl ether derivatives as highly potent enoyl-ACP reductase inhibitors through molecular dynamics simulations and 3D-QSAR study

Pharit Kamsri, Auradee Punkvang, Patchareenart Saparpakorn, Supa Hannongbua, Stephan Irle, Pornpan Pungpo J. Mol. Model., accepted (May 21, 2014). DOI: 10.1007/s00894-014-2319-0 Online date: June 2014 Diphenyl ether derivatives are good...

16th Jun 2014
A Strap Strategy for Construction of an Excited-State Intramolecular Proton Transfer (ESIPT) System with Dual Fluorescence

A Strap Strategy for Construction of an Excited-State Intramolecular Proton Transfer (ESIPT) System with Dual Fluorescence

N. Suzuki, A Fukazawa, K. Nagura, S.Saito, H. Kitor-Nishioka, D. Yokogawa, S.Irle, S. Yamaguchi Angew. Chem. 2014, 126, 1 – 6 DOI: 10.1002/ange.201404867 Article first published online: 16 JUN 2014...

02nd Jun 2014
ja-2014-032369_0011

Super-Reduced Polyoxometalates: Excellent Molecular Cluster Battery Components and Semipermeable Molecular Capacitors

Yoshio Nishimoto, Daisuke Yokogawa, Hirofumi Yoshikawa, Kunio Awaga, and Stephan Irle J. Am. Chem. Soc., Article ASAP DOI: 10.1021/ja5032369 Publication Date (Web): June 2, 2014 Theoretical investigations are presented on...