1. Raghvendra Gupta, Amit Kumar, Mudrika Singhal, "A Critical Review of Multiphase Modelling of Blood Flow in Human Cardiovascular System", Journal of the Indian Institute of Science, 104, 39-63, https://doi.org/10.1007/s41745-024-00430-y [2024]

2. P Rajasekhar Reddy, K Anki Reddy, Amit Kumar, "Comparative Retention Analysis of Intercalated Cations inside the Interlayer Gallery of Lamellar and Nonlamellar Graphene Oxide Membranes in Reverse Osmosis Process: A Molecular Dynamics Study", The Journal of Physical Chemistry B, 128, 21, 5218-5227, https://doi.org/10.1021/acs.jpcb.4c01623 [2024]

1. Kishant Kumar, Anand Bharti, Ajay Kumar, Surya K. Ghosh, Amit Kumar, "Choline based deep eutectic solvent for denitrogenation of liquid fuel: A molecular dynamics study", Journal of Molecular Liquids, 382, 121862, https://www.sciencedirect.com/science/article/pii/S0167732223006657 [2023]

2. Doli Hazarika, Gourhari Chakraborty, Amit Kumar, Vimal Katiyar, "Role of silk nanocrystal (SNC)-ZnO as an antibacterial nucleating nanohybrid for a patterned mimic poly(lactic acid) based nanofabric", International Journal of Biological Macromolecules, 242, 3, 125126, https://www.sciencedirect.com/science/article/pii/S0141813023020202?via%3Dihub [2023]

3. P Rajasekhar Reddy, Amit Kumar, K Anki Reddy, "Understanding the boron rejection of cation intercalated multilayered graphene oxide (GO) membrane in reverse osmosis (RO) process: A Molecular Dynamics study", Journal of Molecular Liquids, 389, 122817, https://doi.org/10.1016/j.molliq.2023.122817 [2023]

4. Manoj Kumar Dhal, Kshitij Madhu, Arnab Banerjee, Varatharajan Prasannavenkadesan, Amit Kumar, Vimal Katiyar, "Polylactic acid/polycaprolactone/sawdust based biocomposites trays with enhanced compostability", International Journal of Biological Macromolecules, 253, 126977, https://doi.org/10.1016/j.ijbiomac.2023.126977 [2023]

1. Doli Hazarika, Naba Kumar Kalita, Amit Kumar, Vimal Katiyar, "Crystalline titanium-dioxide nanofinish impregnated on electrospun stereocomplex poly (lactic acid) as non-woven nanotextile with superhydrophilic, anti-shrinkage, dark dyeing and waste dye removal ability for sustainable application", International Journal of Biological Macromolecules, 219, 384-394, https://www.sciencedirect.com/science/article/pii/S0141813022015252 [2022]

2. Doli Hazarika, Amit Kumar, Vimal Katiyar, "Structural evolution of in situ polymerized poly(L-lactic acid) nanocomposite for smart textile application", Scientific Reports, 12, 14724, https://www.nature.com/articles/s41598-022-17437-z [2022]

3. Chethana Mudenur, Pankaj Boruah, Amit Kumar, Vimal Katiyar, "Prodigiosin-Loaded Poly (lactic acid) to Combat the Biofilm-Associated Infections", ACS Applied Bio Materials, 5, 5, 2143-2151, https://pubs.acs.org/doi/full/10.1021/acsabm.1c01187 [2022]

1. Surendra Singh Gaur, Prodyut Dhar, Khalid Mehmood Wani, Muskan Srivastava, Shinichi Sakurai, Amit Kumar, Vimal Katiyar, "Ion transfer channel network formed by flower and rod shape crystals of hair hydrolysate in poly(vinyl alcohol) matrix and its application as anion exchange membrane in fuel cells", Journal of Colloid and Interface Science, 587, 214-228, https://doi.org/10.1016/j.jcis.2020.12.012 [2021]

2. Richa Sharma, Amit Kumar, Rajesh K. Upadhyay, "Characteristics of a multi-pass membrane reactor to improve hydrogen recovery", International Journal of Hydrogen Energy, 46, 27, 14429-14440, https://doi.org/10.1016/j.ijhydene.2020.05.079 [2021]

3. Doli Hazarika, Naba Kumar Kalita, Amit Kumar, Vimal Katiyar, "Functionalized poly(lactic acid) based nano-fabric for anti-viral applications", RSC Advances, 11, 52, 32884- 32897, https://pubs.rsc.org/en/content/articlelanding/2021/ra/d1ra05352c [2021]

1. Surendra Singh Gaur, Prodyut Dhar, Soundararajan Narendren, Shinichi Sakurai, Amit Kumar, Vimal Katiyar, "Fabrication and characterization of clay nanoscrolls and stable zerovalent iron using montmorillonite", Applied Clay Science, 193, 105670, https://doi.org/10.1016/j.clay.2020.105670 [2020]

2. Prodyut Dhar, Soundararajan Narendren, Surendra Singh Gaur, Saksham Sharma, Amit Kumar, Vimal Katiyar, "Self-propelled cellulose nanocrystal based catalytic nanomotors for targeted hyperthermia and pollutant remediation applications", International Journal of Biological Macromolecules, 158, 1020-1036, https://doi.org/10.1016/j.ijbiomac.2020.04.204 [2020]

3. Siddharth Mohan Bhasney, Amit Kumar, Vimal Katiyar, "Microcrystalline cellulose, polylactic acid and polypropylene biocomposites and its morphological, mechanical, thermal and rheological properties", Composites Part B: Engineering, 184, 107717, https://doi.org/10.1016/j.compositesb.2019.107717 [2020]

4. Siddharth Mohan Bhasney, Kona Mondal, Amit Kumar, Vimal Katiyar, "Effect of microcrystalline cellulose [MCC] fibres on the morphological and crystalline behaviour of high density polyethylene [HDPE]/polylactic acid [PLA] blends", Composites Science and Technology, 187, 107941, https://doi.org/10.1016/j.compscitech.2019.107941 [2020]

1. R Patwa, M Singh, A Kumar, V Katiyar , "Kinetic modelling of thermal degradation and non-isothermal crystallization of silk nano-discs reinforced poly (lactic acid) bionanocomposites", Polymer Bulletin, 76, 3, 1349-1382, https://doi.org/10.1007/s00289-018-2434-7 [2019]

2. Surendra Singh Gaur, Prodyut Dhar, Shinichi Sakurai, Amit Kumar, Vimal Katiyar, "Cellulose nanocrystal/clay based macroion nanogel as support for stable platinum catalyst for electrochemical oxidation of methanol in alkaline medium", Applied Clay Science, 182, 105277, https://doi.org/10.1016/j.clay.2019.105277 [2019]

3. Richa Sharma, Amit Kumar, Rajesh K. Upadhyay, "Bimetallic Fe‐Promoted Catalyst for CO‐Free Hydrogen Production in High‐Temperature‐Methanol Steam Reforming", ChemCatChem, 11, 18, 4568-4580, https://doi.org/10.1002/cctc.201901062 [2019]

4. Siddharth Mohan Bhasney, Purabi Bhagabati, Amit Kumar, Vimal Katiyar, "Morphology and crystalline characteristics of polylactic acid [PLA]/linear low density polyethylene [LLDPE]/microcrystalline cellulose [MCC] fiber composite", Composites Science and Technology , 171, 54-61, https://doi.org/10.1016/j.compscitech.2018.11.028 [2019]

1. P Dhar, SS Gaur, A Kumar,V Katiyar , "Cellulose Nanocrystal Templated Graphene Nanoscrolls for High Performance Supercapacitors and Hydrogen Storage: An Experimental and Molecular Simulation Study", Scientific Reports, 8, 1, 3886-Nil, https://doi.org/10.1038/s41598-018-22123-0 [2018]

2. R Sharma, A Kumar, RK Upadhyay , , "Characteristic of a multi-pass membrane separator for hydrogen separation through self-supported PdAg membranes", International Journal of Hydrogen Energy, 43, 10, 5019-5032 [2018]

3. R Patwa, A Kumar, V Katiyar, "Crystallization kinetics, morphology, and hydrolytic degradation of novel bio-based poly (lactic acid)/crystalline silk nano-discs nanobiocomposites", Journal of Applied Polymer Science, 135, 33, 46590-Nil [2018]

4. R Patwa, A Kumar, V Katiyar , "Effect of silk nano-disc dispersion on mechanical, thermal, and barrier properties of poly (lactic acid) based bionanocomposites", Journal of Applied Polymer Science, 135, 38, 46671, https://doi.org/10.1002/app.46671 [2018]

5. K Kumar, A Kumar , "Enhanced CO2 Adsorption and Separation in Ionic Liquid-Impregnated Mesoporous Silica MCM-41: A Molecular Simulation Study", The Journal of Physical Chemistry C, 122, 15, 8216-8227, https://doi.org/10.1021/acs.jpcc.7b11529 [2018]

6. Prodyut Dhar, Rajesh Kumar M, Siddharth M Bhasney, Purabi Bhagabati, Amit Kumar, Vimal Katiyar, "Sustainable Approach for Mechanical Recycling of Poly (lactic acid)/Cellulose Nanocrystal Films: Investigations on Structure–Property Relationship and Underlying Mechanism", Industrial & Engineering Chemistry Research, 57, 43, 14493-14508, https://doi.org/10.1021/acs.iecr.8b02658 [2018]

7. Rahul Patwa, Narendren Soundararajan, Neha Mulchandani, Siddharth M Bhasney, Manisha Shah, Sachin Kumar, Amit Kumar, Vimal Katiyar, "Silk nano-discs: A natural material for cancer therapy", Biopolymers, 109, 11, e23231, https://doi.org/10.1002/bip.23231 [2018]

8. Kishant Kumar, Amit Kumar, "Adsorptive separation of carbon dioxide from flue gas using mesoporous MCM-41: A molecular simulation study", Korean Journal of Chemical Engineering, 35, 535-547, https://doi.org/10.1007/s11814-017-0283-y [2018]

1. Prodyut Dhar, Umesh Bhardwaj, Amit Kumar, Vimal Katiyar , "Investigations on rheological and mechanical behavior of poly(3-Hydroxybutyrate)/cellulose nanocrystal based nanobiocomposites", Polymer Composites, 38, E392-E401 [2017]

2. Siddharth Mohan Bhasney, Rahul Patwa, Amit Kumar, Vimal Katiyar, "Plasticizing effect of coconut oil on morphological, mechanical, thermal, rheological, barrier, and optical properties of poly(lactic acid): A promising candidate for food packaging", Journal of Applied Polymer Science, 134 , 41, 45390, https://doi.org/10.1002/app.45390 [2017]

3. Richa Sharma, Amit Kumar, Rajesh K Upadhyay, "Performance comparison of methanol steam reforming integrated to Pd-Ag membrane: Membrane reformer vs. membrane separator", Separation and Purification Technology , 183, 194-203, https://doi.org/10.1016/j.seppur.2017.04.006 [2017]

4. Richa Sharma, Amit Kumar, Rajesh K. Upadhyay, "Catalytic Sol Assisted Dense Pd/γ-Al2O3 Membrane using Modified Electroless Plating: Effect of Process on Surface Morphology", Chemical Product and Process Modeling, 12, 2, 20160023, https://doi.org/10.1515/cppm-2016-0023 [2017]

5. Chandra Sekhar Bandi, R. Uppaluri, Amit Kumar, "Global optimality of RO seawater desalination networks with permeate reprocessing and recycle", Separation Science and Technology, 52, 7, 1225-1239, https://doi.org/10.1080/01496395.2017.1284867 [2017]

6. Prodyut Dhar, Surendra Singh Gaur, Narendren Soundararajan, Arvind Gupta, Siddharth Mohan Bhasney, Medha Milli, Amit Kumar, Vimal Katiyar, "Reactive Extrusion of Polylactic Acid/Cellulose Nanocrystal Films for Food Packaging Applications: Influence of Filler Type on Thermomechanical, Rheological, and Barrier Properties", Industrial & Engineering Chemistry Research, 56, 16, 4718-4735, https://doi.org/10.1021/acs.iecr.6b04699 [2017]

7. Surendra Singh Gaur, Prodyut Dhar, Amrita Sonowal, Akanksha Sharma, Amit Kumar, Vimal Katiyar, "Thermo-mechanically Stable Sustainable Polymer Based Solid Electrolyte Membranes for Direct Methanol Fuel Cell Applications", Journal of Membrane Science, 526, 348-354, https://doi.org/10.1016/j.memsci.2016.12.030 [2017]

1. Suman Mahato, Amit Kumar, Tamal Banerjee , , "PC-SAFT predictions on mixtures of 1-alkyl-3methylimidazolium-bis(trifluroromethanesulphonyl)amide with hydrocarbons, alcohols and aqueous systems using a correlative based binary interaction parameter", Journal of the Taiwan Institute of Chemical Engineers, 59, 69-78 [2016]

2. Prodyut Dhar, Debashis Tarafder, Amit Kumar,Vimal Katiyar , "Thermally recyclable polylactic acid/cellulose nanocrystal films through reactive extrusion process", Polymer, 87, 268-282 [2016]

3. Prodyut Dhar, Siddharth Mohan Bhasney, Amit Kumar, Vimal Katiyar, "Acid functionalized cellulose nanocrystals and its effect on mechanical, thermal, crystallization and surface properties of poly (lactic acid) bionanocomposite films: A comprehensive study", Polymer, 101, 75-92, https://doi.org/10.1016/j.polymer.2016.08.028 [2016]

4. Akshay Sridhar, Amit Kumar, Ashok Kumar Dasmahapatra, "Multi-scale molecular dynamics study of cholera pentamer binding to a GM1-phospholipid membrane", Journal of Molecular Graphics and Modelling, 68, 236-251, https://doi.org/10.1016/j.jmgm.2016.07.007 [2016]

5. Chandra Sekhar Bandi, R. Uppaluri, Amit Kumar, "Global optimality of hybrid MSF-RO seawater desalination processes", Desalination, 400, 47-59, https://doi.org/10.1016/j.desal.2016.09.021 [2016]

6. Chandra Sekhar Bandi, R. Uppaluri, Amit Kumar, "Global optimization of MSF seawater desalination processes", Desalination, 394, 30-43, https://doi.org/10.1016/j.desal.2016.04.012 [2016]

7. Prodyut Dhar, Amit Kumar, Vimal Katiyar, "Magnetic Cellulose Nanocrystal Based Anisotropic Polylactic Acid Nanocomposite Films: Influence on Electrical, Magnetic, Thermal, and Mechanical Properties", ACS Applied Materials & Interfaces, 8, 28, 18393-18409, https://doi.org/10.1021/acsami.6b02828 [2016]

1. Akshay Sridhar, Bharath Srikanth, Amit Kumar, Ashok Kumar Dasmahapatra , "Coarse-grain molecular dynamics study of fullerene transport across a cell membrane", The Journal of Chemical Physics, 143, 24907-24907 [2015]

2. ProdyutDhar, Debashis Tarafder, Amit Kumar,Vimal Katiyar , "Effect of cellulose nanocrystal polymorphs on mechanical, barrier and thermal properties of poly(lactic acid) based bionanocomposites", RSC Advances, 5, 74, 60426-60440 [2015]

3. ProdyutDhar, Amit Kumar, Vimal Katiyar , , "Fabrication of cellulose nanocrystal supported stable Fe(0) nanoparticles: a sustainable catalyst for dye reduction, organic conversion and chemo-magnetic propulsion", Cellulose, 22, 6, 3755-3771 [2015]

4. Prodyut Dhar, Umesh Bhardwaj, Amit Kumar,Vimal Katiyar , "Poly (3-hydroxybutyrate)/cellulose nanocrystal films for food packaging applications: Barrier and migration studies", Polymer Engineering & Science, 55, 10, 2388-2395 [2015]

1. Prodyut Dhar, Sai Phani Kumar Vangala, Pankaj Tiwari, Amit Kumar, Vimal Katiyar, "Thermal Degradation Kinetics of Poly (3-hydroxybutyrate)/Cellulose Nanocrystals based Nanobiocomposite", Journal of Thermodynamics & Catalysis , 5, 2, 1000134, http://dx.doi.org/10.4172/2157-7544.1000134 [2014]

2. Surendra Singh Gaur, Prodyut Dhar, Amit Kumar, Vimal Katiyar, "Prospects of poly (vinyl alcohol)/Chitosan/poly (styrene sulfonic acid) and montmorillonite Cloisite® 30B clay composite membrane for direct methanol fuel cells", Journal of Renewable and Sustainable Energy, 6, 5, 053135, https://doi.org/10.1063/1.4899192 [2014]

1. A. Kumar, R. F. Lobo, N. J. Wagner, "Grand canonical Monte Carlo simulation of adsorption of nitrogen and oxygen in realistic nanoporous carbon models", AIChE Journal, 57, 6, 1496-1505, https://doi.org/10.1002/aic.12356 [2011]

1. A. Kumar, R. F. Lobo, N. J. Wagner, "Porous amorphous carbon models from periodic Gaussian chains of amorphous polymers", Carbon, 43, 15, 3099-3111, https://doi.org/10.1016/j.carbon.2005.06.030 [2005]