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Molecular Informatics|August 23, 2016
A Virtual Screening Study for Lactate Dehydrogenase 5 Inhibitors by Using a Pharmacophore-based ApproachTiziano Tuccinardi, Giulio Poli, Isacco Corchia, et al.Molecular Informatics|March 31, 2021
Machine Learning Methods to Predict the Terrestrial and Marine Origin of Natural ProductsFlorbela PereiraMolecular Informatics|March 31, 2021
An Integrative in silico Drug Repurposing Approach for Identification of Potential Inhibitors of SARS-CoV-2 Main ProteaseNemanja Djokovic, Dusan Ruzic, Teodora Djikic, et al.Molecular Informatics|August 25, 2020
BANΔIT: B'-Factor Analysis for Drug Design and Structural BiologyFabian Barthels, Tanja Schirmeister, Christian KerstenMolecular Informatics|August 25, 2020
Dynamic-shared Pharmacophore Approach as Tool to Design New Allosteric PRC2 Inhibitors, Targeting EED Binding PocketJessica Lombino, Maria Rita Gulotta, Giada De Simone, et al.Molecular Informatics|May 18, 2023
Exploring activity landscapes with extended similarity: is Tanimoto enough?Timothy B Dunn, Edgar López-López, Taewon David Kim, et al.Molecular Informatics|April 27, 2021
Targeting SARS-CoV-2 Spike Protein/ACE2 Protein-Protein Interactions: a Computational StudyDavide Pirolli, Benedetta Righino, Maria Cristina De RosaMolecular Informatics|May 16, 2023
Novel Inhibitors of androgen receptor's DNA binding domain identified using an ultra-large virtual screeningMariia Radaeva, Helene Morin, Mohit Pandey, et al.Molecular Informatics|May 17, 2023
In silico prediction of drug-induced liver injury with a complementary integration strategy based on hybrid representationYaxin Gu, Yimeng Wang, Zengrui Wu, et al.Molecular Informatics|July 30, 2020
Cheminformatics in Natural Product-based Drug DiscoveryYa Chen, Johannes KirchmairPageof 101