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Ramil Nugmanov

Showing results (1-10 of 14) with videos related to

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Journal of Chemical Information and Modeling|March 30, 2024
PaCh (Packed Chemicals): Computationally Effective Binary Format for Chemical Structure EncodingRamil Nugmanov
Journal of Chemical Information and Modeling|July 6, 2022
Bidirectional Graphormer for Reactivity Understanding: Neural Network Trained to Reaction Atom-to-Atom Mapping TaskRamil Nugmanov, Natalia Dyubankova, Andrey Gedich, et al.
Journal of Computer-Aided Molecular Design|July 29, 2017
Structure-reactivity modeling using mixture-based representation of chemical reactionsPavel Polishchuk, Timur Madzhidov, Timur Gimadiev, et al.
Journal of Cheminformatics|February 27, 2025
Pretraining graph transformers with atom-in-a-molecule quantum properties for improved ADMET modelingAlessio Fallani, Ramil Nugmanov, Jose Arjona-Medina, et al.
Journal of Chemical Information and Modeling|November 29, 2021
CGRdb2.0: A Python Database Management System for Molecules, Reactions, and Chemical DataTimur Gimadiev, Ramil Nugmanov, Aigul Khakimova, et al.
Journal of Chemical Information and Modeling|January 27, 2021
Combined Graph/Relational Database Management System for Calculated Chemical Reaction Pathway DataTimur Gimadiev, Ramil Nugmanov, Dinar Batyrshin, et al.
Molecular Informatics|August 23, 2018
Predictive Models for Kinetic Parameters of Cycloaddition ReactionsMarta Glavatskikh, Timur Madzhidov, Dragos Horvath, et al.
Molecular Informatics|July 25, 2018
Visualization and Analysis of Complex Reaction Data: The Case of Tautomeric EquilibriaMarta Glavatskikh, Timur Madzhidov, Igor I Baskin, et al.
Journal of Cheminformatics|February 11, 2023
Global reactivity models are impactful in industrial synthesis applicationsPaulo Neves, Kelly McClure, Jonas Verhoeven, et al.
Molecular Informatics|November 24, 2018
Bimolecular Nucleophilic Substitution Reactions: Predictive Models for Rate Constants and Molecular Reaction Pairs AnalysisTimur Gimadiev, Timur Madzhidov, Igor Tetko, et al.
Pageof 2

Showing results (1-10 of 14) with videos related to

Sort By:
Pageof 2
Journal of Chemical Information and Modeling|March 30, 2024
PaCh (Packed Chemicals): Computationally Effective Binary Format for Chemical Structure EncodingRamil Nugmanov
Journal of Chemical Information and Modeling|July 6, 2022
Bidirectional Graphormer for Reactivity Understanding: Neural Network Trained to Reaction Atom-to-Atom Mapping TaskRamil Nugmanov, Natalia Dyubankova, Andrey Gedich, et al.
Journal of Computer-Aided Molecular Design|July 29, 2017
Structure-reactivity modeling using mixture-based representation of chemical reactionsPavel Polishchuk, Timur Madzhidov, Timur Gimadiev, et al.
Journal of Cheminformatics|February 27, 2025
Pretraining graph transformers with atom-in-a-molecule quantum properties for improved ADMET modelingAlessio Fallani, Ramil Nugmanov, Jose Arjona-Medina, et al.
Journal of Chemical Information and Modeling|November 29, 2021
CGRdb2.0: A Python Database Management System for Molecules, Reactions, and Chemical DataTimur Gimadiev, Ramil Nugmanov, Aigul Khakimova, et al.
Journal of Chemical Information and Modeling|January 27, 2021
Combined Graph/Relational Database Management System for Calculated Chemical Reaction Pathway DataTimur Gimadiev, Ramil Nugmanov, Dinar Batyrshin, et al.
Molecular Informatics|August 23, 2018
Predictive Models for Kinetic Parameters of Cycloaddition ReactionsMarta Glavatskikh, Timur Madzhidov, Dragos Horvath, et al.
Molecular Informatics|July 25, 2018
Visualization and Analysis of Complex Reaction Data: The Case of Tautomeric EquilibriaMarta Glavatskikh, Timur Madzhidov, Igor I Baskin, et al.
Journal of Cheminformatics|February 11, 2023
Global reactivity models are impactful in industrial synthesis applicationsPaulo Neves, Kelly McClure, Jonas Verhoeven, et al.
Molecular Informatics|November 24, 2018
Bimolecular Nucleophilic Substitution Reactions: Predictive Models for Rate Constants and Molecular Reaction Pairs AnalysisTimur Gimadiev, Timur Madzhidov, Igor Tetko, et al.
Pageof 2