Publications

This is our catalog of publications authored by IBM researchers, in collaboration with the global research community. It’s an ever-growing body of work that shows why IBM is one of the most important contributors to modern computing.

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71 results for Payel Das

A Small Step Toward Generalizability: Training a Machine Learning Scoring Function for Structure-Based Virtual Screening
- - Jack Scantlebury
  - Lucy Vost
  - et al.
- 2023
- J. Chem. Inf. Model.
Explaining Artificial Intelligence Generation and Creativity: Human interpretability for novel ideas and artifacts
- - Payel Das
  - Lav R. Varshney
- 2022
- IEEE SPM
Active Sampling of Multiple Sources for Sequential Estimation
- - Arpan Mukherjee
  - Ali Tajer
  - et al.
- 2021
- IEEE TSP
Machine learning models in the prediction of drug metabolism: challenges and future perspectives
- - Eleni E. Litsa
  - Payel Das
  - et al.
- 2021
- Expert Opinion on Drug Metabolism and Toxicology
Nanoscale Interplay of Membrane Composition and Amyloid Self-Assembly
- - Sneha Menon
  - Neelanjana Sengupta
  - et al.
- 2020
- Journal of Physical Chemistry B
How Hydrophobic Hydration Destabilizes Surfactant Micelles at Low Temperature: A Coarse-Grained Simulation Study
- - Gregory S. Custer
  - Hongcheng Xu
  - et al.
- 2018
- Langmuir
Femtosecond Hydration Map of Intrinsically Disordered α-Synuclein
- - Shruti Arya
  - Avinash K. Singh
  - et al.
- 2018
- Biophysical Journal
A2T and A2V Aβ peptides exhibit different aggregation kinetics, primary nucleation, morphology, structure, and LTP inhibition
- - Brian Murray
  - Mirco Sorci
  - et al.
- 2016
- Proteins
Alzheimer's protective A2T mutation changes the conformational landscape of the Aβ_1-42 monomer differently than does the A2V mutation
- - Payel Das
  - Brian Murray
  - et al.
- 2015
- Biophysical Journal
Multistage unfolding of an SH3 domain: An initial urea-filled dry molten globule precedes a wet molten globule with non-native structure
- - Amrita Dasgupta
  - Jayant B. Udgaonkar
  - et al.
- 2014
- Journal of Physical Chemistry B