Hari Prasad Lamichhane

Molecular simulation, vibrational spectroscopy and global reactivity descriptors of pseudoephedrine molecule in different phases and states

Ramesh Rijal, Manoj Sah, Hari Prasad Lamichhane · Heliyon · 2023 · 27 citations · Full text

Excited State Property, Pseudoephedrine Molecule, Molecular Spectroscopy +13

Calculated vibrational properties of pigments in protein binding sites

Hari Prasad Lamichhane, Gary Hastings · Proceedings of the National Academy of Sciences · 2011 · 26 citations

Biological Protein Complexes, Molecular Spectroscopy, Ftir Difference Spectra +15

Molecular structure, homo-lumo analysis and vibrational spectroscopy of the cancer healing pro-drug temozolomide based on dft calculations

Ramesh Rijal, Hari Prasad Lamichhane, Kiran Pudasainee · AIMS Biophysics · 2022 · 25 citations · Full text

Vibrational Modes, Computational Chemistry, Chemistry +16

Quantum chemical calculations of nicotine and caffeine molecule in gas phase and solvent using DFT methods

Ramesh Rijal, Manoj Sah, Hari Prasad Lamichhane et al. · Heliyon · 2022 · 20 citations · Full text

Identification of potent inhibitors of HDAC2 from herbal products for the treatment of colon cancer: Molecular docking, molecular dynamics simulation, MM/GBSA calculations, DFT studies, and pharmacokinetic analysis

Madan Khanal, A. Acharya, Rajesh Maharjan et al. · PLoS ONE · 2024 · 19 citations · Full text