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Computational Biology and Chemistry|April 17, 2022
The method predicting interaction between protein targets and small-molecular ligands with the wide applicability domainDmitry A Karasev, Boris N Sobolev, Alexey A Lagunin, et al.
Voprosy Meditsinskoi Khimii|January 1, 1997
[The search for new antiulcer agents using a computer system for predicting the antiulcer activity]V A Trapkov, A P Budunova, O A Burova, et al.
SAR and QSAR in Environmental Research|September 25, 2019
Improving (Q)SAR predictions by examining bias in the selection of compounds for experimental testingP V Pogodin, A A Lagunin, D A Filimonov, et al.
Frontiers in Immunology|February 20, 2025
Sequence-structure based prediction of pathogenicity for amino acid substitutions in proteins associated with primary immunodeficienciesEkaterina S Porfireva, Anton D Zadorozhny, Anastasia V Rudik, et al.
Toxicological Sciences : an Official Journal of the Society of Toxicology|March 14, 2015
Identification of drug targets related to the induction of ventricular tachyarrhythmia through a systems chemical biology approachSergey M Ivanov, Alexey A Lagunin, Pavel V Pogodin, et al.
ACS Omega|December 11, 2023
MetaTox 2.0: Estimating the Biological Activity Spectra of Drug-like Compounds Taking into Account Probable BiotransformationsAnastasia V Rudik, Alexander V Dmitriev, Alexey A Lagunin, et al.
Journal of Molecular Recognition : JMR|November 10, 2015
Prediction of amino acid positions specific for functional groups in a protein family based on local sequence similarityDmitry A Karasev, Alexander V Veselovsky, Nina Yu Oparina, et al.
Journal of Cheminformatics|August 13, 2022
Chemical named entity recognition in the texts of scientific publications using the naïve Bayes classifier approachO A Tarasova, A V Rudik, N Yu Biziukova, et al.
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