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Total posts by Reactor: 72
presentation
·
5 months ago
Impurity Identification Using LC-MS and in silico Reaction Enumeration
by
Tamas Juhasz
news
·
5 months ago
Wendy Warr's Report: Cheminfo Stories 2020
by
Wendy Warr
presentation
·
6 months ago
Library Enumeration - The Future of Reactor and Plexus Design
by
Árpád Figyelmesi
presentation
·
1 year ago
AnalytiCon: Relying on Reactor and Plexus Connect
by
Lars Ole Haustedt
(
ChemAxon
,
AnalytiCon
)
presentation
·
1 year ago
ChemAxon Portfolio
by
Dávid Malatinszky
(
ChemAxon
)
presentation
·
1 year ago
ChemAxon Product Portfolio
by
Dávid Malatinszky
(
ChemAxon
)
publication
·
2 years ago
227 Views of RNA: Is RNA Unique in Its Chemical Isomer Space?
by
Markus Meringer
,
H. James Cleaves II
,
Jay Goodwin
(
Tokyo Institute of Technology
,
Princeton University
,
Blue Marble Space Institute of Science
,
Georgia Institute of Technology
,
Earth Observation Center (EOC)
,
Emory University
)
presentation
·
2 years ago
ChemAxon and Arxspan
by
Jim Martin
(
Arxspan
)
news
·
3 years ago
ChemAxon and Simmaren Form Strategic Partnership to Accelerate the Development of New Software for the Prediction of Human Drug Metabolism
(
ChemAxon
,
Simmaren
)
ChemAxon
press release
PR
Simmaren
presentation
·
3 years ago
Current Application domains and ChemAxon functionality
by
Tim Dudgeon
(
Informatics Matters
)
Partner
presentation
·
3 years ago
Closing the gap between organic synthesis and bioactive chemical space
by
Gergely Makara
(
ChemPass
)
Partner
presentation
·
3 years ago
ChemAxon partnering Iomics
by
Dan Corkill
(
Iomics
)
Partner
presentation
·
3 years ago
Arxspan partnering ChemAxon
by
James Martin
(
Arxspan
)
Partner
presentation
·
4 years ago
AMRI Leverages Instant JChem for Compound Libraries
by
Michelle DelleFave
(
AMRI
)
news
·
4 years ago
ChemAxon European Annual Meeting (UGM), Budapest, May 24-26, 2016
by
Wendy Warr
(
Wendy Warr & Associates
)
meeting report
presentation
·
5 years ago
Plexus Design
by
Ágnes Peragovics
(
ChemAxon
)
presentation
·
5 years ago
ChemAxon and IDBS - A brief history
by
Anthony Barnardo
(
IDBS
)
Partner
news
·
6 years ago
ChemAxon European User Group Meeting (UGM), Budapest, May 19-21, 2014
by
Wendy Warr
(
Wendy Warr & Associates
)
meeting report
publication
·
6 years ago
Synthesis and Nicotinic Receptor Activity of Chemical Space Analogues of N-(3R)-1-Azabicyclo[2.2.2]oct-3-yl-4-chlorobenzamide (PNU-282,987) and 1,4-Diazabicyclo[3.2.2]nonane-4-carboxylic Acid 4-Bromophenyl Ester (SSR180711)
by
Daniel Bertrand
,
Jean-Louis Reymond
,
Sonia Bertrand
,
Lise Bréthous
,
Noemi Garcia-Delgado
,
Julian Schwartz
(
University of Berne
,
HiQScreen
)
presentation
·
6 years ago
Evolution of the ChemAxon product portfolio
by
Petr Hamernik
,
Iván Solt
,
András Strácz
,
Miklós Szabó
,
Tim Aitken
(
ChemAxon
)
presentation
·
7 years ago
Recent Improvements in Marvin 6.0 Version: Reaction Atom Mapping and its Application to Reaction Validation in Pharmaceutical ELNs
by
Roger Sayle
,
Daniel M. Lowe
(
NextMove Software
)
presentation
·
7 years ago
[email protected]
by
Jonathan Davies
(
IDBS
)
Partner
publication
·
7 years ago
Novel Kinase Inhibitors by Reshuffling Ligand Functionalities Across the Human Kinome
by
Steven Muskal
,
Stephan C. Schürer
,
Dušica Vidović
(
Eidogen-Sertanty
,
University of Miami
)
presentation
·
7 years ago
Reaction Library Design
by
Anna Tomin
(
ChemAxon
)
publication
·
7 years ago
Enabling Large-Scale Design, Synthesis and Validation of Small Molecule Protein-Protein Antagonists
by
Wei Wang
,
Alexander Dömling
,
David Koes
,
Kareem Khoury
,
Yijun Huang
,
Michal Bista
,
Grzegorz M. Popowicz
,
Siglinde Wolf
,
Tad A. Holak
,
Carlos J. Camacho
(
University of Pittsburgh
,
Max Planck Institute of Biochemistry
)
publication
·
8 years ago
Combinatorial synthesis of chemically diverse core-shell nanoparticles for intracellular delivery
by
Daniel J. Siegwart
,
Kathryn A. Whitehead
,
Lutz Nuhn
,
Gaurav Sahay
,
Hao Cheng
,
Shan Jiang
,
Minglin Ma
,
Abigail Lytton-Jean
,
Arturo Vegas
,
Patrick Fenton
,
Christopher G. Levins
,
Kevin T. Love
,
Haeshin Lee
,
Christina Cortez
,
Sean P. Collins
,
Ying Fei Li
(
Harvard Medical School
,
Massachusetts Institute of Technology
,
Alnylam Pharmaceuticals
,
Harvard-MIT Division of Health Sciences and Technology
)
webinar
·
8 years ago
Demonstration of JChem for Excel and Reactor
by
David Deng
(
ChemAxon
)
publication
·
8 years ago
CyBy2: A Structure-based Data Management Tool for Chemical and Biological Data
by
Stefan Höck
,
Rainer Riedl
(
ZHAW Wädenswil
)
publication
·
8 years ago
The University of Minnesota Pathway Prediction System: multi-level prediction and visualization
by
Lawrence P. Wackett
,
Lynda B. M. Ellis
,
Junfeng Gao
(
University of Minnesota
)
publication
·
8 years ago
The University of Minnesota pathway prediction system: predicting metabolic logic
by
Kathrin Fenner
,
Lawrence P. Wackett
,
Lynda B. M. Ellis
,
Junfeng Gao
(
University of Minnesota
,
Eawag
,
ETH Zurich
)
publication
·
8 years ago
The University of Minnesota Biocatalysis / Biodegradation Database: the first decade
by
Lawrence P. Wackett
,
Lynda B. M. Ellis
,
Dave Roe
(
University of Minnesota
)
webinar
·
8 years ago
Demonstration of JChem for Excel and Reactor
by
David Deng
publication
·
8 years ago
FiehnLib - mass spectral and retention index libraries for metabolomics based on quadrupole and time-of-flight gas chromatography/mass spectrometry
by
Tobias Kind
,
Oliver Fiehn
,
Gert Wohlgemuth
,
Do Yup Lee
,
Yun Lu
,
Mine Palazoglu
,
Sevini Shahbaz
(
University of California Davis
)
publication
·
8 years ago
Applying
in-silico
retention index and mass spectra matching for identification of unknown metabolites in accurate mass GC-TOF mass spectrometry
by
Tobias Kind
,
Oliver Fiehn
,
Sangeeta Kumari
,
Doug Stevens
,
Carsten Denkert
(
University of California Davis
,
Waters Corp.
,
Charite University Clinics
)
news
·
8 years ago
IDBS extends partnership with ChemAxon to boost ELN parallel synthesis capabilities
(
IDBS
)
idbs
ChemBook
presentation
·
8 years ago
The right reaction - ChemAxon in IDBS E-WorkBook
by
Jonathan Davies
(
IDBS
)
presentation
·
8 years ago
Demonstration of ChemAxon's Database Management Tools (JChem for Excel and Instant JChem) and virtual library design with Reactor
by
David Deng
(
ChemAxon
)
publication
·
9 years ago
Screening Multicomponent Reactions for X-Linked Inhibitor of Apoptosis-Baculoviral Inhibitor of Apoptosis Protein Repeats Domain Binder
by
Alexander Dömling
,
Ilaria Monfardini
,
Jui-Wen Huang
,
Barbara Beck
,
Jason F. Cellitti
,
Maurizio Pellecchia
(
University of Pittsburgh
)
publication
·
9 years ago
Chemoinformatics: Theory, Practice and Products; Chapter 2.7
by
Barry Bunin
,
Jurgen Bajorath
,
Brian Siesel
,
Guillermo Morales
(
Collaborative Drug Discovery
,
University of Bonn
)
publication
·
9 years ago
Making "Real" Molecules in Virtual Space
by
Szilárd Dóránt
,
Miklós Vargyas
,
György Pirok
,
József Szegezdi
,
Ferenc Csizmadia
,
Nóra Máté
,
Jenő Varga
(
ChemAxon
)
publication
·
9 years ago
A screening study of ChirBase molecular database to explore the expanded chiral pool derived from the application of chiral chromatography
by
Patrick Piras
,
Christian Roussel
(
Universite Paul Cezanne Aix-Marseille III
)
publication
·
9 years ago
Reactor
by
Jeffrey W. Bode
(
University of California Santa Barbara
)
presentation
·
9 years ago
Reaction scheme: Capture, Iterator, and Parser
by
Zhenbin Li
(
Boehringer Ingelheim
)
presentation
·
9 years ago
Reactor - switching on the manual gear
by
David Deng
(
ChemAxon
)
publication
·
9 years ago
Chemical phylogenetics of histone deacetylases
by
James E Bradner
,
Nathan West
,
Melissa L. Grachan
,
Edward F. Greenberg
,
Stephen J. Haggarty
,
Tandy Warnow
,
Ralph Mazitschek
(
Dana-Farber Cancer Institute
)
presentation
·
9 years ago
Collaborative R&D
by
Derek Hayes
(
KineMatik
)
Partner
presentation
·
9 years ago
Reactor - switching on the manual gear
by
Iván Solt
(
ChemAxon
)
presentation
·
9 years ago
Virtual Libraries and Virtual Screening in Drug Discovery Processes using KNIME
by
Tímea Polgár
,
Attila Tajti
,
Iván Solt
(
ChemAxon
)
tutorial
·
10 years ago
Reactor in Instant JChem
(
ChemAxon
)
tutorial
·
10 years ago
Reactor demonstration
(
ChemAxon
)
presentation
·
10 years ago
Virtual reaction design for chemists
by
György Pirok
(
ChemAxon
)
tutorial
·
10 years ago
JChem for Excel - Reactor
(
ChemAxon
)
presentation
·
10 years ago
Virtual reaction design for chemists
by
György Pirok
(
ChemAxon
)
presentation
·
10 years ago
Reactor - Virtual synthesis
by
György Pirok
(
ChemAxon
)
tutorial
·
11 years ago
Reaction editor GUI
(
ChemAxon
)
tutorial
·
11 years ago
Reactor GUI animation
(
ChemAxon
)
presentation
·
11 years ago
Command line tools of ChemAxon: tips and tricks
by
György Pirok
(
ChemAxon
)
presentation
·
11 years ago
Virtual synthesis and metabolism - new development
by
György Pirok
(
ChemAxon
)
presentation
·
11 years ago
Experiences with Reactor in Pipeline Pilot
by
Isabella Haight
(
Abbott Laboratories
)
presentation
·
11 years ago
Command line tools of ChemAxon: tips and tricks
by
György Pirok
(
ChemAxon
)
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