Search research articles
Contact Us
Filters
Showing results (71-80 of 158) with videos related to
Page
of 16
Sort By:
Molecular Informatics
|
April 30, 2020
Parallel Generative Topographic Mapping: An Efficient Approach for Big Data Handling
Arkadii Lin, Igor I Baskin, Gilles Marcou, et al.
Chemmedchem
|
November 21, 2017
Mapping of the Available Chemical Space versus the Chemical Universe of Lead-Like Compounds
Arkadii Lin, Dragos Horvath, Valentina Afonina, et al.
Journal of Chemical Information and Modeling
|
September 14, 2022
Chemspace Atlas: Multiscale Chemography of Ultralarge Libraries for Drug Discovery
Yuliana Zabolotna, Fanny Bonachera, Dragos Horvath, et al.
Journal of Chemical Information and Modeling
|
July 25, 2022
HyFactor: A Novel Open-Source, Graph-Based Architecture for Chemical Structure Generation
Tagir Akhmetshin, Arkadii Lin, Daniyar Mazitov, et al.
Combinatorial Chemistry & High Throughput Screening
|
March 10, 2015
Prediction of drug induced liver injury using molecular and biological descriptors
Christophe Muller, Dumrongsak Pekthong, Eliane Alexandre, et al.
Journal of Computer-Aided Molecular Design
|
December 3, 2014
Continuous indicator fields: a novel universal type of molecular fields
Gleb V Sitnikov, Nelly I Zhokhova, Yury A Ustynyuk, et al.
Angewandte Chemie (International Ed. in English)
|
January 23, 2023
Predicting Highly Enantioselective Catalysts Using Tunable Fragment Descriptors
Nobuya Tsuji, Pavel Sidorov, Chendan Zhu, et al.
Journal of Chemical Information and Modeling
|
February 21, 2019
De Novo Molecular Design by Combining Deep Autoencoder Recurrent Neural Networks with Generative Topographic Mapping
Boris Sattarov, Igor I Baskin, Dragos Horvath, et al.
The Journal of Organic Chemistry
|
December 3, 2011
Electronic, spectroscopic, and ion-sensing properties of a dehydro[m]pyrido[14]- and [15]annulene isomer library
Paul N W Baxter, Abdelaziz Al Ouahabi, Jean-Paul Gisselbrecht, et al.
Journal of Chemical Information and Modeling
|
November 29, 2021
CGRdb2.0: A Python Database Management System for Molecules, Reactions, and Chemical Data
Timur Gimadiev, Ramil Nugmanov, Aigul Khakimova, et al.
Page
of 16
Search research articles
Search
Showing results (71-80 of 158) with videos related to
Sort By:
Page
of 16
Molecular Informatics
|
April 30, 2020
Parallel Generative Topographic Mapping: An Efficient Approach for Big Data Handling
Arkadii Lin, Igor I Baskin, Gilles Marcou, et al.
Chemmedchem
|
November 21, 2017
Mapping of the Available Chemical Space versus the Chemical Universe of Lead-Like Compounds
Arkadii Lin, Dragos Horvath, Valentina Afonina, et al.
Journal of Chemical Information and Modeling
|
September 14, 2022
Chemspace Atlas: Multiscale Chemography of Ultralarge Libraries for Drug Discovery
Yuliana Zabolotna, Fanny Bonachera, Dragos Horvath, et al.
Journal of Chemical Information and Modeling
|
July 25, 2022
HyFactor: A Novel Open-Source, Graph-Based Architecture for Chemical Structure Generation
Tagir Akhmetshin, Arkadii Lin, Daniyar Mazitov, et al.
Combinatorial Chemistry & High Throughput Screening
|
March 10, 2015
Prediction of drug induced liver injury using molecular and biological descriptors
Christophe Muller, Dumrongsak Pekthong, Eliane Alexandre, et al.
Journal of Computer-Aided Molecular Design
|
December 3, 2014
Continuous indicator fields: a novel universal type of molecular fields
Gleb V Sitnikov, Nelly I Zhokhova, Yury A Ustynyuk, et al.
Angewandte Chemie (International Ed. in English)
|
January 23, 2023
Predicting Highly Enantioselective Catalysts Using Tunable Fragment Descriptors
Nobuya Tsuji, Pavel Sidorov, Chendan Zhu, et al.
Journal of Chemical Information and Modeling
|
February 21, 2019
De Novo Molecular Design by Combining Deep Autoencoder Recurrent Neural Networks with Generative Topographic Mapping
Boris Sattarov, Igor I Baskin, Dragos Horvath, et al.
The Journal of Organic Chemistry
|
December 3, 2011
Electronic, spectroscopic, and ion-sensing properties of a dehydro[m]pyrido[14]- and [15]annulene isomer library
Paul N W Baxter, Abdelaziz Al Ouahabi, Jean-Paul Gisselbrecht, et al.
Journal of Chemical Information and Modeling
|
November 29, 2021
CGRdb2.0: A Python Database Management System for Molecules, Reactions, and Chemical Data
Timur Gimadiev, Ramil Nugmanov, Aigul Khakimova, et al.
Page
of 16