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Journal of Chemical Information and Modeling
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December 1, 2018
In-Silico Extraction of Design Ideas Using MMPA-by-QSAR and its Application on ADME Endpoints
Alexios Koutsoukas, George Chang, Christopher E Keefer
Journal of Cheminformatics
|
November 1, 2017
Deep-learning: investigating deep neural networks hyper-parameters and comparison of performance to shallow methods for modeling bioactivity data
Alexios Koutsoukas, Keith J Monaghan, Xiaoli Li, et al.
The Journal of Chemical Physics
|
July 9, 2021
Cartesian message passing neural networks for directional properties: Fast and transferable atomic multipoles
Zachary L Glick, Alexios Koutsoukas, Daniel L Cheney, et al.
Human Psychopharmacology
|
July 25, 2013
Computer-aided (in silico) approaches in the mode-of-action analysis and safety assessment of ostarine and 4-methylamphetamine
Fazlin Mohd Fauzi, Alexios Koutsoukas, Andrew Cunningham, et al.
Combinatorial Chemistry & High Throughput Screening
|
March 10, 2015
Comparing global and local likelihood score thresholds in multiclass laplacian-modified Naive Bayes protein target prediction
Georgios Drakakis, Alexios Koutsoukas, Suzanne C Brewerton, et al.
Journal of Ayurveda and Integrative Medicine
|
August 10, 2013
Linking Ayurveda and Western medicine by integrative analysis
Fazlin Mohd Fauzi, Alexios Koutsoukas, Robert Lowe, et al.
Journal of Chemical Information and Modeling
|
January 29, 2013
Chemogenomics approaches to rationalizing the mode-of-action of traditional Chinese and Ayurvedic medicines
Fazlin Mohd Fauzi, Alexios Koutsoukas, Robert Lowe, et al.
The Journal of Chemical Physics
|
July 9, 2021
CLIFF: A component-based, machine-learned, intermolecular force field
Jeffrey B Schriber, Daniel R Nascimento, Alexios Koutsoukas, et al.
Chemical Biology & Drug Design
|
May 8, 2013
Diversity selection of compounds based on 'protein affinity fingerprints' improves sampling of bioactive chemical space
Ha P Nguyen, Alexios Koutsoukas, Fazlin Mohd Fauzi, et al.
The Journal of Chemical Physics
|
August 6, 2020
AP-Net: An atomic-pairwise neural network for smooth and transferable interaction potentials
Zachary L Glick, Derek P Metcalf, Alexios Koutsoukas, et al.
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of 2
Search research articles
Search
Showing results (1-10 of 18) with videos related to
Sort By:
Page
of 2
Journal of Chemical Information and Modeling
|
December 1, 2018
In-Silico Extraction of Design Ideas Using MMPA-by-QSAR and its Application on ADME Endpoints
Alexios Koutsoukas, George Chang, Christopher E Keefer
Journal of Cheminformatics
|
November 1, 2017
Deep-learning: investigating deep neural networks hyper-parameters and comparison of performance to shallow methods for modeling bioactivity data
Alexios Koutsoukas, Keith J Monaghan, Xiaoli Li, et al.
The Journal of Chemical Physics
|
July 9, 2021
Cartesian message passing neural networks for directional properties: Fast and transferable atomic multipoles
Zachary L Glick, Alexios Koutsoukas, Daniel L Cheney, et al.
Human Psychopharmacology
|
July 25, 2013
Computer-aided (in silico) approaches in the mode-of-action analysis and safety assessment of ostarine and 4-methylamphetamine
Fazlin Mohd Fauzi, Alexios Koutsoukas, Andrew Cunningham, et al.
Combinatorial Chemistry & High Throughput Screening
|
March 10, 2015
Comparing global and local likelihood score thresholds in multiclass laplacian-modified Naive Bayes protein target prediction
Georgios Drakakis, Alexios Koutsoukas, Suzanne C Brewerton, et al.
Journal of Ayurveda and Integrative Medicine
|
August 10, 2013
Linking Ayurveda and Western medicine by integrative analysis
Fazlin Mohd Fauzi, Alexios Koutsoukas, Robert Lowe, et al.
Journal of Chemical Information and Modeling
|
January 29, 2013
Chemogenomics approaches to rationalizing the mode-of-action of traditional Chinese and Ayurvedic medicines
Fazlin Mohd Fauzi, Alexios Koutsoukas, Robert Lowe, et al.
The Journal of Chemical Physics
|
July 9, 2021
CLIFF: A component-based, machine-learned, intermolecular force field
Jeffrey B Schriber, Daniel R Nascimento, Alexios Koutsoukas, et al.
Chemical Biology & Drug Design
|
May 8, 2013
Diversity selection of compounds based on 'protein affinity fingerprints' improves sampling of bioactive chemical space
Ha P Nguyen, Alexios Koutsoukas, Fazlin Mohd Fauzi, et al.
The Journal of Chemical Physics
|
August 6, 2020
AP-Net: An atomic-pairwise neural network for smooth and transferable interaction potentials
Zachary L Glick, Derek P Metcalf, Alexios Koutsoukas, et al.
Page
of 2