Results 141 to 150 of about 4,446,617 (245)

A Comprehensive 19F NMR Framework for Fragment‐Based Drug Discovery: The Validated Screening Library OpenFL600 and Efficient Affinity Ranking by CSAR

Angewandte Chemie, EarlyView.
NMR screening is a powerful method for hit detection in drug‐discovery. We designed and validated the OpenFL600 19F$^{19}{\rm F}$ NMR library to probe diverse targets, including RNA, GPCRs, kinases, and proteases. This library yields target‐specific ligands without generating promiscuous binders.
Simon H. Rüdisser, Gabriela Stadler, Giacomo Padroni, Daria Barbash, Marco M. Ruckstuhl, Nils Lorz, Christina Jordan, Sarah Skibinski, Timo T. Stühlinger, Sarah E. Kratzwald, Katharina M. Siess, Sven Brüschweiler, Gerald Platzer, Antoine Cléry, Robert Konrat, Frédéric H.‐.T. Allain, Alvar D. Gossert   +16 more
wiley   +2 more sources

Protein Structure Determination by Racemic and Quasi-Racemic X-Ray Crystallography. [PDF]

Chembiochem
Kent SBH.
europepmc   +1 more source

The evolving role of structural biology in pharma: integration of X-ray crystallography, cryo-electron microscopy and beyond. [PDF]

Acta Crystallogr D Struct Biol
Chrencik JE, Su HP, Gomez Llorente Y, Palte RL, Klein DJ, Hayes RP, Antine SP, Asmar-Rovira GA, Bertoletti N, Byrne NJ, Carroll BL, Cordeiro CD, Curfman K, Dutko J, Eddins MJ, Fischmann T, Govindarajan B, Hecksel CW, Ho T, Hollenstein K, Hong MR, Hruza A, Ishchenko A, Jaime-Garza M, Jaremko MJ, Knox HL, Kostas J, Krishnamurthy H, Manolaridis I, Noland CL, Partridge AT, Patel SB, Reichert P, Reid JC, Felisberto-Rodrigues C, Shintre CA, Shipman JM, Tamilselvan E, Walker ME, Walker SN, Wang R, Wright KM, Yen TJ, Yoo BK, Gabelli SB.   +44 more
europepmc   +1 more source

Diastereoselective and Chemically Reversible C-C Bond Formation Mediated by an (N-heterocyclic)boryloxy Aluminyl Compound. [PDF]

J Am Chem Soc
Sarkar D, Vasko P, Struijs JJC, Dietz M, Aldridge S.   +4 more
europepmc   +1 more source

Pinpointing Protein Crystal Structures over a Broad Temperature Range Using Hydrophobic Protection. [PDF]

ACS Omega
Ribeiro FS, Lima LMTR.
europepmc   +1 more source

Visualization of Chemical Reactions by Crystallography

Nihon Kessho Gakkaishi, 2013
ADACHI, Shin-ichi, UEKUSA, Hidehiro, OZEKI, Tomoji, KAWANO, Masaki, KURISU, Genji   +4 more
openaire   +2 more sources

Complexes of DOTAM with d¹⁰ Divalent Metal Ions: X-ray Diffraction and NMR Studies in Solution and the Solid State. [PDF]

Inorg Chem
Obuch J, Císařová I, Czernek J, Brus J, Hermann P.   +4 more
europepmc   +1 more source

Cycloazulenylene

Angewandte Chemie International Edition, EarlyView.
A strained macrocycle consisting solely of azulene subunits, named [6]cycloparaazulenylene ([6]CPA), is presented. The macrocycle exhibits a notably narrow HOMO–LUMO gap for a pristine azulene species, strain‐induced red‐shifted absorption, and an unusual tubular packing motif elucidated via single‐crystal XRD.
Clara Douglas, Josefine Sprachmann, David Dunlop, Joël Schlecht, Jörg Neudörfl, Tommy Wachsmuth, Julian Frost, Tomáš Slanina, Oliver Dumele   +8 more
wiley   +1 more source

Erratum: Differences in hierarchical structural changes between unoriented P(3HB) and P(3HB-<i>co</i>-3HH) under stretching. Corrigendum. [PDF]

J Appl Crystallogr
Arakawa M, Kabe T, Iwata T, Takenaka M.
europepmc   +1 more source

How crystallography in synergy with spectroscopy and computation catalyzed a career in chemical crystallography [PDF]

Acta Crystallographica Section A Foundations and Advances, 2018
openaire   +1 more source