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

Por Jamal, Salma, Goyal, Sukriti, Shanker, Asheesh, Grover, Abhinav
Publicado no PLoS One (2015)

Structural investigations of T854A mutation in EGFR and identification of novel inhibitors using structure activity relationships

Por Goyal, Sukriti, Jamal, Salma, Shanker, Asheesh, Grover, Abhinav
Publicado no BMC Genomics (2015)

Integrating network, sequence and functional features using machine learning approaches towards identification of novel Alzheimer genes

Por Jamal, Salma, Goyal, Sukriti, Shanker, Asheesh, Grover, Abhinav
Publicado no BMC Genomics (2016)

Mechanistic Insights into the Binding of Class IIa HDAC Inhibitors toward Spinocerebellar Ataxia Type-2: A 3D-QSAR and Pharmacophore Modeling Approach

Por Sinha, Siddharth, Goyal, Sukriti, Somvanshi, Pallavi, Grover, Abhinav
Publicado no Front Neurosci (2017)

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

Por Jamal, Salma, Goyal, Sukriti, Shanker, Asheesh, Grover, Abhinav
Publicado no Sci Rep (2017)

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

Por Jamal, Salma, Kumari, Anchala, Singh, Aditi, Goyal, Sukriti, Grover, Abhinav
Publicado no Front Neurosci (2017)

Computational identification of novel natural inhibitors of glucagon receptor for checking type II diabetes mellitus

Por Grover, Sonam, Dhanjal, Jaspreet Kaur, Goyal, Sukriti, Grover, Abhinav, Sundar, Durai
Publicado no BMC Bioinformatics (2014)

Fragment based group QSAR and molecular dynamics mechanistic studies on arylthioindole derivatives targeting the α-β interfacial site of human tubulin

Por Tyagi, Chetna, Gupta, Ankita, Goyal, Sukriti, Dhanjal, Jaspreet Kaur, Grover, Abhinav
Publicado no BMC Genomics (2014)

Structural studies on molecular mechanisms of Nelfinavir resistance caused by non-active site mutation V77I in HIV-1 protease

Por Gupta, Ankita, Jamal, Salma, Goyal, Sukriti, Jain, Ritu, Wahi, Divya, Grover, Abhinav
Publicado no BMC Bioinformatics (2015)

Molecular modeling and lead design of substituted zanamivir derivatives as potent anti-influenza drugs

Por Dholakia, Dhwani, Goyal, Sukriti, Jamal, Salma, Singh, Aditi, Das, Asmita, Grover, Abhinav
Publicado no BMC Bioinformatics (2016)

Mechanistic insights into mode of action of novel natural cathepsin L inhibitors

Por Tyagi, Chetna, Grover, Sonam, Dhanjal, Jaspreet Kaur, Goyal, Sukriti, Goyal, Manisha, Grover, Abhinav
Publicado em 2013

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

Por Goyal, Manisha, Dhanjal, Jaspreet Kaur, Goyal, Sukriti, Tyagi, Chetna, Hamid, Rabia, Grover, Abhinav
Publicado em 2014

Mechanistic analysis elucidating the relationship between Lys96 mutation in Mycobacterium tuberculosis pyrazinamidase enzyme and pyrazinamide susceptibility

Por Vats, Chakshu, Dhanjal, Jaspreet Kaur, Goyal, Sukriti, Gupta, Ankita, Bharadvaja, Navneeta, Grover, Abhinav
Publicado no BMC Genomics (2015)

Cheminformatics models based on machine learning approaches for design of USP1/UAF1 abrogators as anticancer agents

Por Wahi, Divya, Jamal, Salma, Goyal, Sukriti, Singh, Aditi, Jain, Ritu, Rana, Preeti, Grover, Abhinav
Publicado no Syst Synth Biol (2015)

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

Por Verma, Sharad, Grover, Sonam, Tyagi, Chetna, Goyal, Sukriti, Jamal, Salma, Singh, Aditi, Grover, Abhinav
Publicado no PLoS One (2016)

Novel group-based QSAR and combinatorial design of CK-1δ inhibitors as neuroprotective agents

Por Joshi, Kopal, Goyal, Sukriti, Grover, Sonam, Jamal, Salma, Singh, Aditi, Dhar, Pawan, Grover, Abhinav
Publicado no BMC Bioinformatics (2016)

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

Por Goyal, Manisha, Grover, Sonam, Dhanjal, Jaspreet Kaur, Goyal, Sukriti, Tyagi, Chetna, Chacko, Sajeev, Grover, Abhinav
Publicado em 2013

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

Por Pandey, Bharati, Grover, Sonam, Goyal, Sukriti, Kumari, Anchala, Singh, Aditi, Jamal, Salma, Kaur, Jagdeep, Grover, Abhinav
Publicado no Sci Rep (2018)

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

Por Dhanjal, Jaspreet Kaur, Sreenidhi, Anith Kumar, Bafna, Khushboo, Katiyar, Shashank Prakash, Goyal, Sukriti, Grover, Abhinav, Sundar, Durai
Publicado no PLoS One (2015)

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

Por Nigam, Nupur, Grover, Abhinav, Goyal, Sukriti, Katiyar, Shashank P., Bhargava, Priyanshu, Wang, Pi-Chao, Sundar, Durai, Kaul, Sunil C., Wadhwa, Renu
Publicado no PLoS One (2015)