Results 41 to 50 of about 1,152,460 (369)

Synthesis of Solution-Phase Phosphoramidite and Phosphite Ligand Libraries and Their In Situ Screening in the Rhodium-Catalyzed Asymmetric Addition of Arylboronic Acids [PDF]

, 2007
Herein, we report the automated parallel synthesis of solution-phase libraries of phosphoramidite ligands for the development of enantioselective catalysts.
Feringa, Ben L.,, Jagt, Richard B.C.,, Minnaard, Adriaan J.,, Schudde, Ebe P.,, Toullec, Patrick Y.,, Vries, Johannes G. de,   +5 more
core   +1 more source

A semantic datagrid for combinatorial chemistry [PDF]

The 6th IEEE/ACM International Workshop on Grid Computing, 2005., 2005
The CombeChem project has designed and deployed an e-science infrastructure using a combination of grid and semantic Web technologies. In this paper we describe the datagrid element of the project, which provides a platform for sophisticated scientific queries and a rich record of experimental data and its provenance.
Taylor, Kieron, Gledhill, Rob, Essex, Jonathan W, Frey, Jeremy G, Harris, Stephen W, De Roure, David   +5 more
openaire   +4 more sources

De novo macrocyclic peptides dissect energy coupling of a heterodimeric ABC transporter by multimode allosteric inhibition

eLife, 2021
ATP-binding cassette (ABC) transporters constitute the largest family of primary active transporters involved in a multitude of physiological processes and human diseases.
Erich Stefan, Richard Obexer, Susanne Hofmann, Khanh Vu Huu, Yichao Huang, Nina Morgner, Hiroaki Suga, Robert Tampé   +7 more
doaj   +1 more source

Library Design in Combinatorial Chemistry by Monte Carlo Methods

, 2000
Strategies for searching the space of variables in combinatorial chemistry experiments are presented, and a random energy model of combinatorial chemistry experiments is introduced.
B. M. Cole, C. J. Geyer, D. E. Akporiaye, E. Danielson, E. Danielson, E. Marinari, E. Reddington, E. W. McFarland, F. M. Menger, G. Briceño, J. Wang, K. Burgess, L. D. Bogarad, M. B. Francis, M. C. Pirrung, M. Falcioni, Marco Falcioni, Michael W. Deem, P. Bratley, P. Cong, R. B. van Dover, S. I. Zones, T. A. Dickinson, T. Novet, W. H. Weinberg, X.-D. Xiang   +25 more
core   +1 more source

Discovery of the cryptic function of terpene cyclases as aromatic prenyltransferases

Nature Communications, 2020
Terpene cyclases catalyze the formation of diverse hydrocarbon scaffolds found in terpenoids. Here, the authors report the cryptic function of class I terpene cyclases as aromatic prenyltransferases and the universality of this cryptic feature is ...
Haibing He, Guangkai Bian, Corey J. Herbst-Gervasoni, Takahiro Mori, Stephen A. Shinsky, Anwei Hou, Xin Mu, Minjian Huang, Shu Cheng, Zixin Deng, David W. Christianson, Ikuro Abe, Tiangang Liu   +12 more
doaj   +1 more source

Dynamic combinatorial chemistry: a tool to facilitate the identification of inhibitors for protein targets.

Chemical Society Reviews, 2015
Dynamic combinatorial chemistry (DCC) has emerged as a powerful strategy to identify ligands for biological targets given that it enables the target to direct the synthesis and amplification of its strongest binder(s) from the library of interconverting ...
M. Mondal, A. Hirsch
semanticscholar   +1 more source

Chemoinformatics Research at the University of Sheffield: A History and Citation Analysis [PDF]

, 2003
This paper reviews the work of the Chemoinformatics Research Group in the Department of Information Studies at the University of Sheffield, focusing particularly on the work carried out in the period 1985-2002.
Bishop, N., Gillet, V.J., Holliday, J.D., Willett, P.   +3 more
core   +1 more source

Sobre o uso de métodos quimiométricos em química combinatória The use of chemometric methods on combinatorial chemistry

Química Nova, 2000
Combinatorial chemistry has emerged as a tool to circumvent a major problem of pharmaceutical industries to discover new lead compounds. A rapid and massive evaluation of a myriad of newly synthesised compounds can be carried out. Combinatorial synthesis
Andrei Leitão, Carlos A. Montanari, Claudio L. Donnici   +2 more
doaj   +1 more source

A user-friendly Matlab program and GUI for the pseudorotation analysis of saturated five-membered ring systems based on scalar coupling constants [PDF]

, 2008
Background: The advent of combinatorial chemistry has revived the interest in five-membered heterocyclic rings as scaffolds in pharmaceutical research. They are also the target of modifications in nucleic acid chemistry.
Hendrickx, Pieter, Martins, José
core   +4 more sources

Synthesis, screening, and sequencing of cysteine-rich one-bead one-compound peptide libraries. [PDF]

, 2008
Cysteine-rich peptides are valued as tags for biarsenical fluorophores and as environmentally important reagents for binding toxic heavy metals. Due to the inherent difficulties created by cysteine, the power of one-bead one-compound (OBOC) libraries has
Greaves, John, Juskowiak, Gary L, McGee, Christopher J, Van Vranken, David L   +3 more
core   +2 more sources