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Journal of Cheminformatics
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August 25, 2015
PubChem atom environments
Volker D Hähnke, Evan E Bolton, Stephen H Bryant
Journal of Cheminformatics
|
December 30, 2014
Prediction-driven matched molecular pairs to interpret QSARs and aid the molecular optimization process
Yurii Sushko, Sergii Novotarskyi, Robert Körner, et al.
Journal of Cheminformatics
|
November 1, 2014
BioPhytMol: a drug discovery community resource on anti-mycobacterial phytomolecules and plant extracts
Arun Sharma, Prasun Dutta, Maneesh Sharma, et al.
Journal of Cheminformatics
|
March 11, 2018
Automated reaction database and reaction network analysis: extraction of reaction templates using cheminformatics
Pieter P Plehiers, Guy B Marin, Christian V Stevens, et al.
Journal of Cheminformatics
|
February 8, 2018
Mordred: a molecular descriptor calculator
Hirotomo Moriwaki, Yu-Shi Tian, Norihito Kawashita, et al.
Journal of Cheminformatics
|
February 1, 2018
Adverse drug reactions triggered by the common HLA-B*57:01 variant: virtual screening of DrugBank using 3D molecular docking
George Van Den Driessche, Denis Fourches
Journal of Cheminformatics
|
July 3, 2021
Twitter integration of chemistry software tools
Naruki Yoshikawa, Ryuichi Kubo, Kazuki Z Yamamoto
Journal of Cheminformatics
|
July 4, 2021
MAYGEN: an open-source chemical structure generator for constitutional isomers based on the orderly generation principle
Mehmet Aziz Yirik, Maria Sorokina, Christoph Steinbeck
Journal of Cheminformatics
|
January 7, 2021
patRoon: open source software platform for environmental mass spectrometry based non-target screening
Rick Helmus, Thomas L Ter Laak, Annemarie P van Wezel, et al.
Journal of Cheminformatics
|
November 30, 2020
A ligand-based computational drug repurposing pipeline using KNIME and Programmatic Data Access: case studies for rare diseases and COVID-19
Alzbeta Tuerkova, Barbara Zdrazil
Page
of 144
Search research articles
Search
Showing results (151-160 of 1,439) with videos related to
Sort By:
Page
of 144
Journal of Cheminformatics
|
August 25, 2015
PubChem atom environments
Volker D Hähnke, Evan E Bolton, Stephen H Bryant
Journal of Cheminformatics
|
December 30, 2014
Prediction-driven matched molecular pairs to interpret QSARs and aid the molecular optimization process
Yurii Sushko, Sergii Novotarskyi, Robert Körner, et al.
Journal of Cheminformatics
|
November 1, 2014
BioPhytMol: a drug discovery community resource on anti-mycobacterial phytomolecules and plant extracts
Arun Sharma, Prasun Dutta, Maneesh Sharma, et al.
Journal of Cheminformatics
|
March 11, 2018
Automated reaction database and reaction network analysis: extraction of reaction templates using cheminformatics
Pieter P Plehiers, Guy B Marin, Christian V Stevens, et al.
Journal of Cheminformatics
|
February 8, 2018
Mordred: a molecular descriptor calculator
Hirotomo Moriwaki, Yu-Shi Tian, Norihito Kawashita, et al.
Journal of Cheminformatics
|
February 1, 2018
Adverse drug reactions triggered by the common HLA-B*57:01 variant: virtual screening of DrugBank using 3D molecular docking
George Van Den Driessche, Denis Fourches
Journal of Cheminformatics
|
July 3, 2021
Twitter integration of chemistry software tools
Naruki Yoshikawa, Ryuichi Kubo, Kazuki Z Yamamoto
Journal of Cheminformatics
|
July 4, 2021
MAYGEN: an open-source chemical structure generator for constitutional isomers based on the orderly generation principle
Mehmet Aziz Yirik, Maria Sorokina, Christoph Steinbeck
Journal of Cheminformatics
|
January 7, 2021
patRoon: open source software platform for environmental mass spectrometry based non-target screening
Rick Helmus, Thomas L Ter Laak, Annemarie P van Wezel, et al.
Journal of Cheminformatics
|
November 30, 2020
A ligand-based computational drug repurposing pipeline using KNIME and Programmatic Data Access: case studies for rare diseases and COVID-19
Alzbeta Tuerkova, Barbara Zdrazil
Page
of 144