Probabilistic approaches in activity prediction
D Filimonov, V Poroikov - 2008 - books.rsc.org
Biological activity has a probabilistic nature, and the most appropriate approaches in activity
prediction are based on the theory of probability. The statistical nature of the maximum …
prediction are based on the theory of probability. The statistical nature of the maximum …
PASS: prediction of biological activity spectra for substances
V Poroikov, D Filimonov - Predictive toxicology, 2005 - taylorfrancis.com
Each pharmaceutical research and development project is aimed at discovering new drugs
for the treatment of certain diseases. The investigation of new pharmaceuticals is carried out …
for the treatment of certain diseases. The investigation of new pharmaceuticals is carried out …
Efficient modeling and active learning discovery of biological responses
High throughput and high content screening involve determination of the effect of many
compounds on a given target. As currently practiced, screening for each new target typically …
compounds on a given target. As currently practiced, screening for each new target typically …
Machine learning concepts and its applications for prediction of diseases based on drug behaviour: An extensive review
DP Singh, B Kaushik - Chemometrics and Intelligent Laboratory Systems, 2022 - Elsevier
Disease prediction system is one of the recent research areas in information processing
technologies such as data mining, machine learning and so on. Especially, the classification …
technologies such as data mining, machine learning and so on. Especially, the classification …
[PDF][PDF] Computer-aided prediction of biological activity spectra. Application for finding and optimization of new leads
V Poroikov, D Filimonov - Rational Approaches to Drug Design, 2001 - akosgmbh.de
Each biologically active compound possesses a number of biological activities. Its specificity
of action is always relative and is defined by the peculiarities of object, dose, route, etc. On …
of action is always relative and is defined by the peculiarities of object, dose, route, etc. On …
Functional random forest with applications in dose-response predictions
Drug sensitivity prediction for individual tumors is a significant challenge in personalized
medicine. Current modeling approaches consider prediction of a single metric of the drug …
medicine. Current modeling approaches consider prediction of a single metric of the drug …
Most-predictive design points for functional data predictors
F Ferraty, P Hall, P Vieu - Biometrika, 2010 - academic.oup.com
We suggest a way of reducing the very high dimension of a functional predictor, X, to a low
number of dimensions chosen so as to give the best predictive performance. Specifically, if X …
number of dimensions chosen so as to give the best predictive performance. Specifically, if X …
Advances in computational methods to predict the biological activity of compounds
C Nantasenamat… - Expert opinion on …, 2010 - Taylor & Francis
Importance of the field: The past decade had witnessed remarkable advances in computer
science which had given rise to many new possibilities including the ability to simulate and …
science which had given rise to many new possibilities including the ability to simulate and …
[HTML][HTML] Machine learning in the prediction of cancer therapy
Resistance to therapy remains a major cause of cancer treatment failures, resulting in many
cancer-related deaths. Resistance can occur at any time during the treatment, even at the …
cancer-related deaths. Resistance can occur at any time during the treatment, even at the …
PASS: prediction of activity spectra for biologically active substances
A Lagunin, A Stepanchikova, D Filimonov… - …, 2000 - academic.oup.com
The concept of the biological activity spectrum was introduced to describe the properties of
biologically active substances. The PASS (prediction of activity spectra for substances) …
biologically active substances. The PASS (prediction of activity spectra for substances) …