Debsindhu Bhowmik Computational Scientist Contact BHOWMIKD@ORNL.GOV All Publications An automated analysis workflow for optimization of force-field parameters using neutron scattering data Collective Excitations in Protein as a Measure of Balance Between its Softness and Rigidity Quasi-elastic Neutron Scattering Reveals Ligand-Induced Protein Dynamics of a G‑Protein-Coupled Receptor... Enhanced Dynamics of Hydrated tRNA on Nanodiamond Surfaces: A Combined Neutron Scattering and MD Simulation Study... Rhodopsin Photoactivation Dynamics Revealed by Quasi-Elastic Neutron Scattering... Enhancing molecular design efficiency: Uniting language models and generative networks with genetic algorithms Transferring a Molecular Foundation Model for Polymer Property Predictions Deep learning workflow for the inverse design of molecules with specific optoelectronic properties... Structural characterization of an intrinsically disordered protein complex using integrated small-angle neutron scattering and computing Adaptive language model training for molecular design... Gating interactions steer loop conformational changes in the active site of the L1 metallo-β-lactamase Computational Workflow for Accelerated Molecular Design Using Quantum Chemical Simulations and Deep Learning Models Enhanced Dynamics of Hydrated tRNA on Nanodiamond Surfaces: A Combined Neutron Scattering and MD Simulation Study Pagination First page « First Previous page ‹â¶Ä¹ Page 1 Current page 2 Key Links Organizations Computing and Computational Sciences Directorate Computational Sciences and Engineering Division Advanced Computing in Health Sciences Section Multiscale Biomedical Systems Group User Facilities
Research Highlight Structural characterization of an intrinsically disordered protein complex using integrated small-angle neutron scattering and computing
