Exploration of Computational Approaches to Predict the Toxicity of Chemical Mixtures

por Kar, Supratik, Leszczynski, Jerzy
Publicado 2019

In Silico Models for Ecotoxicity of Pharmaceuticals

por Roy, Kunal, Kar, Supratik
Publicado 2016

From Animal to Human: Interspecies Analysis Provides a Novel Way of Ascertaining and Fighting COVID-19

por Kar, Supratik, Leszczynski, Jerzy
Publicado 2020

Are we ready to fight the Nipah virus pandemic? An overview of drug targets, current medications, and potential leads

por Yang, Siyun, Kar, Supratik
Publicado 2023

Computational Modeling of Human Serum Albumin Binding of Per- and Polyfluoroalkyl Substances Employing QSAR, Read-Across, and Docking

por Gallagher, Andrea, Kar, Supratik, Sepúlveda, Maria S.
Publicado 2023

How Precise Are Our Quantitative Structure–Activity Relationship Derived Predictions for New Query Chemicals?

por Roy, Kunal, Ambure, Pravin, Kar, Supratik
Publicado 2018

Impact of Pharmaceuticals on the Environment: Risk Assessment Using QSAR Modeling Approach

por Kar, Supratik, Roy, Kunal, Leszczynski, Jerzy
Publicado 2018

Are we ready to combat the ecotoxicity of COVID-19 pharmaceuticals? An in silico aquatic risk assessment

por Khan, Kabiruddin, Kar, Supratik, Roy, Kunal
Publicado 2023

Insight into the optoelectronic properties of designed solar cells efficient tetrahydroquinoline dye-sensitizers on TiO(2)(101) surface: first principles approach

por Roy, Juganta K., Kar, Supratik, Leszczynski, Jerzy
Publicado 2018

Optoelectronic Properties of C(60) and C(70) Fullerene Derivatives: Designing and Evaluating Novel Candidates for Efficient P3HT Polymer Solar Cells

por Roy, Juganta K., Kar, Supratik, Leszczynski, Jerzy
Publicado 2019

Other Related Techniques

por Roy, Kunal, Kar, Supratik, Das, Rudra Narayan
Publicado 2015

Editorial: Exploration of Natural Product Leads for Multitarget-Based Treatment of Cancer—Computational to Experimental Journey

por Singla, Rajeev K., Scotti, Marcus T., Kar, Supratik
Publicado 2022

The kernel-weighted local polynomial regression (KwLPR) approach: an efficient, novel tool for development of QSAR/QSAAR toxicity extrapolation models

por Gajewicz-Skretna, Agnieszka, Kar, Supratik, Piotrowska, Magdalena, Leszczynski, Jerzy
Publicado 2021

Repurposing FDA approved drugs as possible anti-SARS-CoV-2 medications using ligand-based computational approaches: sum of ranking difference-based model selection

por De, Priyanka, Kumar, Vinay, Kar, Supratik, Roy, Kunal, Leszczynski, Jerzy
Publicado 2022

Therapeutics for COVID-19: from computation to practices—where we are, where we are heading to

por Ojha, Probir Kumar, Kar, Supratik, Krishna, Jillella Gopala, Roy, Kunal, Leszczynski, Jerzy
Publicado 2020