Pratyush Tiwary

Publication Activity (10 Years)

Years Active: 2021-2024
Publications (10 Years): 9

Top Topics

Chaotic Time Series

Recurrent Neural Networks

Statistical Learning

Top Venues

J. Chem. Inf. Model.

Publications

Zachary Smith, Michael Strobel, Bodhi P. Vani, Pratyush Tiwary
Graph Attention Site Prediction (GrASP): Identifying Druggable Binding Sites Using Graph Neural Networks with Attention. J. Chem. Inf. Model. 64 (7) (2024)
Bodhi P. Vani, Akashnathan Aranganathan, Pratyush Tiwary
Exploring Kinase Asp-Phe-Gly (DFG) Loop Conformational Stability with AlphaFold2-RAVE. J. Chem. Inf. Model. 64 (7) (2024)
Ziyue Zou, Pratyush Tiwary
Enhanced sampling of Crystal Nucleation with Graph Representation Learnt Variables. CoRR (2023)
Shams Mehdi, Zachary Smith, Lukas Herron, Ziyue Zou, Pratyush Tiwary
Enhanced Sampling with Machine Learning: A Review. CoRR (2023)
Sun-Ting Tsai, Eric Fields, Pratyush Tiwary
Path sampling of recurrent neural networks by incorporating known physics. CoRR (2022)
Luke Evans, Maria K. Cameron, Pratyush Tiwary
Computing committors via Mahalanobis diffusion maps with enhanced sampling data. CoRR (2022)
Dedi Wang, Yihang Wang, Luke Evans, Pratyush Tiwary
Introducing dynamical constraints into representation learning. CoRR (2022)
Shams Mehdi, Pratyush Tiwary
Thermodynamics of Interpretation. CoRR (2022)
Luke Evans, Maria K. Cameron, Pratyush Tiwary
Computing committors in collective variables via Mahalanobis diffusion maps. CoRR (2021)