Nanda Ghoshal

发表

Molecular Shape Analysis-Guided Virtual Screening Platform for Adenosine Kinase Inhibitors

Savita Bhutoria, Ballari Das, Nanda Ghoshal, 2016, Bioinformatics and biology insights.

Protein-bound fragment based virtual screening (PFVS) approach to identify potential lead fragments as BACE1 inhibitors

Nanda Ghoshal, Prabu Manoharan, 2010, Neuroscience Research.

Rationalizing fragment based drug discovery for BACE1: insights from FB-QSAR, FB-QSSR, multi objective (MO-QSPR) and MIF studies

Nanda Ghoshal, Prabu Manoharan, R. S. K. Vijayan, 2010, J. Comput. Aided Mol. Des..

Combinatorial Library Enumeration and Lead Hopping using Comparative Interaction Fingerprint Analysis and Classical 2D QSAR Methods for Seeking Novel GABAA α3 Modulators

Nanda Ghoshal, Prabu Manoharan, Sangita Saha, 2009, J. Chem. Inf. Model..

Target specific proteochemometric model development for BACE1 - protein flexibility and structural water are critical in virtual screening.

Nanda Ghoshal, Prabu Manoharan, Kiranmai Chennoju, 2015, Molecular bioSystems.

Hybrid Structure-Based Virtual Screening Protocol for the Identification of Novel BACE1 Inhibitors

Nanda Ghoshal, Prabu Manoharan, R. S. K. Vijayan, 2009, J. Chem. Inf. Model..

Modeling the Closed and Open State Conformations of the GABAA Ion Channel - Plausible Structural Insights for Channel Gating

Neha Trivedi, Dhananjay Bhattacharyya, Nanda Ghoshal, 2012, J. Chem. Inf. Model..

Exploration of a Binding Mode of Benzothiazol-2-yl Acetonitrile Pyrimidine Core Based Derivatives as Potent c-Jun N-Terminal Kinase-3 Inhibitors and 3D-QSAR Analyses

Pooja Sharma, Nanda Ghoshal, N. Ghoshal, 2006, J. Chem. Inf. Model..

Exploration of Rate-Limiting Conformational State for 5-[(7-Chloro-4-quinolinyl)amino]-3-[(alkylamino)methyl][1, 1'-biphenyl]-2-ols and Nω-Oxides (Tebuquine Analogues) for Antimalarial Activity Using Molecular Shape Analysis and Molecular Field Analysis Studies

Pooja Sharma, Nitin Rai, Nanda Ghoshal, 2007, J. Chem. Inf. Model..

Combined Ligand and Structure Based Approaches for Narrowing on the Essential Physicochemical Characteristics for CDK4 Inhibition

Nanda Ghoshal, Nahren Manuel Mascarenhas, 2008, J. Chem. Inf. Model..

Yet another linear notation scheme for organic compounds. 1

Nanda Ghoshal, Nanda Ghoshal, 1990, J. Chem. Inf. Comput. Sci..

Structural basis for ligand recognition at the benzodiazepine binding site of GABAA alpha 3 receptor, and pharmacophore-based virtual screening approach.

Nanda Ghoshal, R. Vijayan, N. Ghoshal, 2008, Journal of molecular graphics & modelling.

3-D-QSAR of N-substituted 4-amino-3,3-dialkyl-2(3H)-furanone GABA receptor modulators using molecular field analysis and receptor surface modelling study.

Nanda Ghoshal, Prasenjit K Mukherjee, 2004, Bioorganic & medicinal chemistry letters.

An efficient tool for identifying inhibitors based on 3D-QSAR and docking using feature-shape pharmacophore of biologically active conformation--a case study with CDK2/cyclinA.

Nanda Ghoshal, Nahren Manuel Mascarenhas, N. Ghoshal, 2008, European journal of medicinal chemistry.

3D-QSAR studies and shape based virtual screening for identification of novel hits to inhibit MbtA in Mycobacterium tuberculosis

Nanda Ghoshal, N. Ghoshal, Lakshmi Maganti, 2015, Journal of biomolecular structure & dynamics.

Probing the structure of Mycobacterium tuberculosis MbtA: model validation using molecular dynamics simulations and docking studies

Nanda Ghoshal, N. Ghoshal, Lakshmi Maganti, 2014, Journal of biomolecular structure & dynamics.

Combined Ligand and Structure Based Approaches for Narrowing on the Essential Physicochemical Characteristics for CDK4 Inhibition.

Nanda Ghoshal, Nahren Manuel Mascarenhas, 2008 .

Quantitative structure -actvity relationship studies of aromatic and heteroaromatic nitro compounds using neural network

Nanda Ghoshal, Sudhindra N. Mukhopadhyay, Tapan K. Ghoshal, 1993 .

Exploring the structure of opioid receptors with homology modeling based on single and multiple templates and subsequent docking: A comparative study

Nanda Ghoshal, Indrani Bera, Indrani Bera, 2011, Journal of molecular modeling.

QUANTITATIVE STRUCTURE-ACTIVITY RELATIONSHIP STUDIES USING ARTIFICIAL NEURAL NETWORKS

Tapan Kumar Ghoshal, Nanda Ghoshal, Basudeb Achari, 1993 .