Predicting neurological Adverse Drug Reactions based on biological, chemical and phenotypic properties of drugs using machine learning models

by Salma Jamal, Sukriti Goyal, Asheesh Shanker, Abhinav Grover
Published 2017-04-01

Checking the STEP-Associated Trafficking and Internalization of Glutamate Receptors for Reduced Cognitive Deficits: A Machine Learning Approach-Based Cheminformatics Study and Its...

by Salma Jamal, Sukriti Goyal, Asheesh Shanker, Abhinav Grover
Published 2015-01-01

Conformational Ensembles of α-Synuclein Derived Peptide with Different Osmolytes from Temperature Replica Exchange Sampling

by Salma Jamal, Anchala Kumari, Aditi Singh, Aditi Singh, Sukriti Goyal, Abhinav Grover
Published 2017-12-01

Structural investigations on mechanism of lapatinib resistance caused by HER-2 mutants.

by Sharad Verma, Sukriti Goyal, Anchala Kumari, Aditi Singh, Salma Jamal, Abhinav Grover
Published 2018-01-01

Development of Dual Inhibitors against Alzheimer’s Disease Using Fragment-Based QSAR and Molecular Docking

by Manisha Goyal, Jaspreet Kaur Dhanjal, Sukriti Goyal, Chetna Tyagi, Rabia Hamid, Abhinav Grover
Published 2014-01-01

Hydrophobic Interactions Are a Key to MDM2 Inhibition by Polyphenols as Revealed by Molecular Dynamics Simulations and MM/PBSA Free Energy Calculations.

by Sharad Verma, Sonam Grover, Chetna Tyagi, Sukriti Goyal, Salma Jamal, Aditi Singh, Abhinav Grover
Published 2016-01-01

Novel Natural Structure Corrector of ApoE4 for Checking Alzheimer’s Disease: Benefits from High Throughput Screening and Molecular Dynamics Simulations

by Manisha Goyal, Sonam Grover, Jaspreet Kaur Dhanjal, Sukriti Goyal, Chetna Tyagi, Sajeev Chacko, Abhinav Grover
Published 2013-01-01

Alanine mutation of the catalytic sites of Pantothenate Synthetase causes distinct conformational changes in the ATP binding region

by Bharati Pandey, Sonam Grover, Sukriti Goyal, Anchala Kumari, Aditi Singh, Salma Jamal, Jagdeep Kaur, Abhinav Grover
Published 2018-01-01

Computational Structure-Based De Novo Design of Hypothetical Inhibitors against the Anti- Inflammatory Target COX-2.

by Jaspreet Kaur Dhanjal, Anith Kumar Sreenidhi, Khushboo Bafna, Shashank Prakash Katiyar, Sukriti Goyal, Abhinav Grover, Durai Sundar
Published 2015-01-01

Targeting Mortalin by Embelin Causes Activation of Tumor Suppressor p53 and Deactivation of Metastatic Signaling in Human Breast Cancer Cells.

by Nupur Nigam, Abhinav Grover, Sukriti Goyal, Shashank P Katiyar, Priyanshu Bhargava, Pi-Chao Wang, Durai Sundar, Sunil C Kaul, Renu Wadhwa
Published 2015-01-01