Showing results (71-80 of 483) with videos related to
Sort By:
Pageof 49
Scientific Reports|November 29, 2023
Streamlining pipeline efficiency: a novel model-agnostic technique for accelerating conditional generative and virtual screening pipelinesKarthik Viswanathan, Manan Goel, Siddhartha Laghuvarapu, et al.Chemical Communications (Cambridge, England)|July 6, 2018
Correction: Model molecules to classify CHO hydrogen-bondsAmol M Vibhute, U Deva Priyakumar, Arthi Ravi, et al.The Biochemical Journal|February 20, 2015
Small-molecule inhibitors of ERK-mediated immediate early gene expression and proliferation of melanoma cells expressing mutated BRafRamin Samadani, Jun Zhang, Amanda Brophy, et al.Journal of Chemical Information and Modeling|August 10, 2021
DeepPocket: Ligand Binding Site Detection and Segmentation using 3D Convolutional Neural NetworksRishal Aggarwal, Akash Gupta, Vineeth Chelur, et al.Physical Chemistry Chemical Physics : PCCP|November 18, 2020
Deep learning enabled inorganic material generatorYashaswi Pathak, Karandeep Singh Juneja, Girish Varma, et al.Physical Chemistry Chemical Physics : PCCP|September 16, 2025
Leveraging high-spin DFT features for prediction of spin state gaps in 3d transition metal complexesAnuj Kumar Ray, Sandeep Nagar, Girish Varma, et al.Journal of Computational Chemistry|May 3, 2024
Deep reinforcement learning in chemistry: A reviewBhuvanesh Sridharan, Animesh Sinha, Jai Bardhan, et al.Chemical Science|October 18, 2021
MEMES: Machine learning framework for Enhanced MolEcular ScreeningSarvesh Mehta, Siddhartha Laghuvarapu, Yashaswi Pathak, et al.The Journal of Physical Chemistry. B|September 18, 2015
Molecular Dynamics Study of the Structure, Flexibility, and Hydrophilicity of PETIM Dendrimers: A Comparison with PAMAM DendrimersSubbarao Kanchi, Gorle Suresh, U Deva Priyakumar, et al.Biophysical Journal|November 3, 2019
Ions Everywhere? Mg2+ in the μ-Opioid GPCR and Atomic Details of Their Impact on FunctionAlexander D MacKerellPageof 49