DeepPurpose: a deep learning library for drug–target interaction prediction
… of drug–target interactions (DTI) is crucial for drug discovery. Recently, deep learning (DL) …
We present DeepPurpose, a comprehensive and easy-to-use DL library for DTI prediction. …
We present DeepPurpose, a comprehensive and easy-to-use DL library for DTI prediction. …
Designing focused chemical libraries enriched in protein-protein interaction inhibitors using machine-learning methods
C Reynès, H Host, AC Camproux… - PLoS computational …, 2010 - journals.plos.org
… space between today's chemical libraries and PPI physico-… libraries enriched in putative
PPI inhibitors. Here, we show how chemoinformatics can assist library design by learning …
PPI inhibitors. Here, we show how chemoinformatics can assist library design by learning …
Predicting drug-target interactions for new drug compounds using a weighted nearest neighbor profile
T Van Laarhoven, E Marchiori - PloS one, 2013 - journals.plos.org
… They are used as current standard benchmark data for comparing the performance of machine
learning algorithms for drug-target interaction. We use these datasets as they are without …
learning algorithms for drug-target interaction. We use these datasets as they are without …
Drug target interaction prediction using machine learning techniques–a review
A Suruliandi, T Idhaya, SP Raja - 2024 - reunir.unir.net
… Researchers have been at work trying to determine new Drug Target Interactions (DTI) that
… to a target. Machine learning (ML) techniques help establish the interaction between drugs …
… to a target. Machine learning (ML) techniques help establish the interaction between drugs …
Prediction of drug–target interaction networks from the integration of chemical and genomic spaces
… , target sequence similarity and the drug–target interaction network … unknown drug–target
interaction networks from chemical … drug–target interaction inference as a supervised learning …
interaction networks from chemical … drug–target interaction inference as a supervised learning …
Drug—target interaction prediction with a deep-learning-based model
L Xie, Z Zhang, S He, X Bo… - 2017 IEEE international …, 2017 - ieeexplore.ieee.org
… In this paper, we modeled drug-target interaction prediction … a deep-learning-based model
to predict potential interactions. … predicted more credible drug-target interactions. What’s more, …
to predict potential interactions. … predicted more credible drug-target interactions. What’s more, …
Gaussian interaction profile kernels for predicting drug–target interaction
… machine learning method that uses the drug–target network … new interactions in a drug–target
interaction network. Formally… 1 , t 2 ,…, t n t } of target proteins. There is also a set of known …
interaction network. Formally… 1 , t 2 ,…, t n t } of target proteins. There is also a set of known …
[HTML][HTML] A comprehensive review of feature based methods for drug target interaction prediction
… target interaction is a prominent research area in the field of drug discovery. It refers to the
recognition of interactions … Wet lab experiments to identify these interactions are expensive as …
recognition of interactions … Wet lab experiments to identify these interactions are expensive as …
A semi-supervised method for drug-target interaction prediction with consistency in networks
H Chen, Z Zhang - PloS one, 2013 - journals.plos.org
… Furthermore, target proteins need also to be predicted for some new drugs without any known
target interaction information. In this paper, a semi-supervised learning method NetCBP is …
target interaction information. In this paper, a semi-supervised learning method NetCBP is …
A systematic prediction of multiple drug-target interactions from chemical, genomic, and pharmacological data
… To predict the drug-target interactions, we have designed a set of in silico tools by … All
these further suggest that the learning algorithms based on the general chemicals and …
these further suggest that the learning algorithms based on the general chemicals and …
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