Swapnil P. Bhujbal

发表

An Intriguing Purview on the Design of Macrocyclic Inhibitors for Unexplored Protein Kinases through Their Binding Site Comparison

J. Hah, Swapnil P. Bhujbal, 2023, Pharmaceuticals.

Rational approach toward COVID-19 main protease inhibitors via molecular docking, molecular dynamics simulation and free energy calculation

S. Cho, Seketoulie Keretsu, S. Bhujbal, 2020, Scientific Reports.

Generation of Non-Nucleotide CD73 Inhibitors Using a Molecular Docking and 3D-QSAR Approach

J. Hah, S. Bhujbal, Swapnil P. Bhujbal, 2021, International journal of molecular sciences.

Receptor-guided 3D-Quantitative Structure-Activity Relationship and Docking Studies of 6-Substituted 2-Arylaminopurines as CDK2 Kinase Inhibitors: 3D-QSAR study of 6-Substituted 2-Arylaminopurines as CDK2 inhibitors

P. K. Balasubramanian, S. Cho, Seketoulie Keretsu, 2017 .

3D-QSAR Assisted Design of Novel 7-Deazapurine Derivatives as TNNI3K Kinase Inhibitors Using Molecular Docking and Molecular Dynamics Simulation

P. K. Balasubramanian, A. Balupuri, S. Cho, 2020 .

Receptor‐guided 3D‐QSAR Study of Anilinoquinazolines as RET Receptor Tyrosine Kinase Antagonists

P. K. Balasubramanian, S. Cho, S. P. Bhujbal, 2019, Bulletin of the Korean Chemical Society.

Design of Novel IRAK4 Inhibitors Using Molecular Docking, Dynamics Simulation and 3D-QSAR Studies

J. Hah, Wei-ying He, S. Bhujbal, 2022, Molecules.

Molecular Modelling Studies on Pyrazole Derivatives for the Design of Potent Rearranged during Transfection Kinase Inhibitors

S. Cho, Seketoulie Keretsu, S. Bhujbal, 2021, Molecules.

3D-QSAR-aided design of potent c-Met inhibitors using molecular dynamics simulation and binding free energy calculation

P. K. Balasubramanian, A. Balupuri, S. Cho, 2018, Journal of biomolecular structure & dynamics.

Design and Synthesis of Aminopyrimidinyl Pyrazole Analogs as PLK1 Inhibitors Using Hybrid 3D-QSAR and Molecular Docking

J. Hah, Hyejin Kim, H. Bae, 2022, Pharmaceuticals.

Macrocyclic effect on inhibitory activity: a modeling study on MerTK inhibitors

P. K. Balasubramanian, S. Cho, S. P. Bhujbal, 2019, Medicinal Chemistry Research.

Design of New Therapeutic Agents Targeting FLT3 Receptor Tyrosine Kinase Using Molecular Docking and 3D-QSAR Approach

S. Cho, Seketoulie Keretsu, Swapnil P. Bhujbal, 2020 .

An Innovative Approach to Address Neurodegenerative Diseases through Kinase-Targeted Therapies: Potential for Designing Covalent Inhibitors

J. Hah, Swapnil P. Bhujbal, 2023, Pharmaceuticals.

In silico studies on 2-substituted phenol quinazoline derivatives as RET receptor tyrosine kinase antagonists

P. K. Balasubramanian, Seung Joo Cho, S. Bhujbal, 2017, Medicinal Chemistry Research.

Gaining Insights into Key Structural Hotspots within the Allosteric Binding Pockets of Protein Kinases

J. Hah, Joonhong Jun, Swapnil P. Bhujbal, 2024, International Journal of Molecular Sciences.

Enantioseparation and molecular modeling study of chiral amines as three naphthaldimine derivatives using amylose or cellulose trisphenylcarbamate chiral stationary phases.

M. Paik, Wonjae Lee, S. Adhikari, 2022, Chirality.