Payel Das

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Erratum to: Discrete Legendre spectral projection methods for Fredholm-Hammerstein integral equations [J. Comput. Appl. Math 278 (2015) 293-305]

Guangqing Long, Gnaneshwar Nelakanti, Payel Das, 2016, J. Comput. Appl. Math..

Discrete Legendre spectral projection methods for Fredholm-Hammerstein integral equations

Guangqing Long, Gnaneshwar Nelakanti, Payel Das, 2015, J. Comput. Appl. Math..

Neurology-as-a-Service for the Developing World pdf

Kush R. Varshney, John Thomas, Justin Dauwels, 2017, ArXiv.

Tuberculosis transmission: Modelled impact of air-tightness in dwellings in the UK

Michael J. Davies, Jonathon Taylor, E. Oikonomou, 2014 .

Nano-Material Configuration Design with Deep Surrogate Langevin Dynamics

Chinmay Hegde, Youssef Mroueh, Giuseppe Romano, 2020, ICLR 2020.

Decentralized Parallel Algorithm for Training Generative Adversarial Nets pdf

Mingrui Liu, Tianbao Yang, Wei Zhang, 2020, NeurIPS.

Comparative study of metamodelling techniques in building energy simulation: Guidelines for practitioners

Staf Roels, Hans Janssen, Liesje Van Gelder, 2014, Simul. Model. Pract. Theory.

Projection and multi projection methods for nonlinear integral equations on the half-line

Gnaneshwar Nelakanti, Payel Das, Nilofar Nahid, 2019, J. Comput. Appl. Math..

Free energy simulations reveal a double mutant avian H5N1 virus hemagglutinin with altered receptor binding specificity

Ajay K. Royyuru, Jingyuan Li, Ruhong Zhou, 2009, J. Comput. Chem..

Toward A Neuro-inspired Creative Decoder pdf

Pin-Yu Chen, Brian Quanz, Jae-wook Ahn, 2019, IJCAI.

CogMol: Target-Specific and Selective Drug Design for COVID-19 Using Deep Generative Models

Aleksandra Mojsilovic, Benjamin Hoover, Vijil Chenthamarakshan, 2020, NeurIPS.

Optimizing Mode Connectivity via Neuron Alignment pdf

Rongjie Lai, Pin-Yu Chen, Prasanna Sattigeri, 2020, NeurIPS.

Looking at the Disordered Proteins through the Computational Microscope

Payel Das, Silvina Matysiak, Jeetain Mittal, 2018, ACS central science.

PepCVAE: Semi-Supervised Targeted Design of Antimicrobial Peptide Sequences pdf

Cícero Nogueira dos Santos, Aleksandra Mojsilovic, Tom Sercu, 2018, 1810.07743.

Discrete Legendre spectral Galerkin method for Urysohn integral equations

Guangqing Long, Gnaneshwar Nelakanti, Payel Das, 2018, Int. J. Comput. Math..

Prediction of drug metabolites using neural machine translation

Lydia E. Kavraki, Payel Das, Eleni E. Litsa, 2020 .

Modeling mutations of influenza virus with IBM Blue Gene

Ajay K. Royyuru, Ruhong Zhou, Tien Huynh, 2011, IBM J. Res. Dev..

Automated brain state identification using graph embedding

Payel Das, Nathan Russell, Hongyuan You, 2017, 2017 International Workshop on Pattern Recognition in Neuroimaging (PRNI).

Accelerating Antimicrobial Discovery with Controllable Deep Generative Models and Molecular Dynamics pdf

Aleksandra Mojsilovic, Tom Sercu, Pin-Yu Chen, 2020, ArXiv.

Towards Better Understanding of Adaptive Gradient Algorithms in Generative Adversarial Nets pdf

Mingrui Liu, Tianbao Yang, Wei Zhang, 2019, ICLR.

Legendre Spectral Projection Methods for Fredholm–Hammerstein Integral Equations

Guangqing Long, Gnaneshwar Nelakanti, Payel Das, 2016, J. Sci. Comput..

Corrigendum to: "Convergence analysis of discrete legendre spectral projection methods for hammerstein integral equations of mixed type" Applied Mathematics and Computation Volume 265, 15 August 2015, Pages 574-601

Gnaneshwar Nelakanti, Payel Das, 2016, Appl. Math. Comput..

Legendre spectral projection methods for Urysohn integral equations

Gnaneshwar Nelakanti, Payel Das, Mitali Madhumita Sahani, 2014, J. Comput. Appl. Math..

Understanding protein landscapes at multi-resolution

Payel Das, 2007 .

Convergence analysis of discrete legendre spectral projection methods for hammerstein integral equations of mixed type

Gnaneshwar Nelakanti, Payel Das, 2015, Appl. Math. Comput..

Explanations based on the Missing: Towards Contrastive Explanations with Pertinent Negatives

Amit Dhurandhar, Karthikeyan Shanmugam, Ronny Luss, 2018, NeurIPS.

Target-Specific and Selective Drug Design for COVID-19 Using Deep Generative Models pdf

Aleksandra Mojsilovic, Vijil Chenthamarakshan, Inkit Padhi, 2020, NeurIPS 2020.

Superconvergence of Iterated Galerkin Method for a Class of Nonlinear Fredholm Integral Equations

Gnaneshwar Nelakanti, Payel Das, Nilofar Nahid, 2019, ICITAM.

Towards creativity characterization of generative models via group-based subset scanning pdf

Skyler Speakman, Pin-Yu Chen, Victor Akinwande, 2021, ArXiv.

Optimizing molecules using efficient queries from property evaluations pdf

Vijil Chenthamarakshan, Pin-Yu Chen, Payel Das, 2020, Nature Machine Intelligence.

Do Large Scale Molecular Language Representations Capture Important Structural Information? pdf

Youssef Mroueh, Vijil Chenthamarakshan, Inkit Padhi, 2021, ArXiv.

Active Estimation From Multimodal Data

Ali Tajer, Pin-Yu Chen, Payel Das, 2021, ICASSP 2021 - 2021 IEEE International Conference on Acoustics, Speech and Signal Processing (ICASSP).

Fold2Seq: A Joint Sequence(1D)-Fold(3D) Embedding-based Generative Model for Protein Design

Vijil Chenthamarakshan, Pin-Yu Chen, Igor Melnyk, 2021, ICML.

Gi and Pal Scores: Deep Neural Network Generalization Statistics pdf

Pin-Yu Chen, Brian Quanz, Payel Das, 2021, ArXiv.

Augmenting Molecular Deep Generative Models with Topological Data Analysis Representations pdf

Karthikeyan Natesan Ramamurthy, Vijil Chenthamarakshan, Payel Das, 2021, ArXiv.

Predicting Deep Neural Network Generalization with Perturbation Response Curves pdf

Pin-Yu Chen, Brian Quanz, Payel Das, 2021, NeurIPS.

Direct characterization of hydrophobic hydration during cold and pressure denaturation.

Payel Das, Silvina Matysiak, Payel Das, 2012, The journal of physical chemistry. B.

Direct characterization of hydrophobic hydration during cold and pressure denaturation.

Payel Das, Silvina Matysiak, 2012 .

Balancing energy and entropy: a minimalist model for the characterization of protein folding landscapes.

Cecilia Clementi, Payel Das, Silvina Matysiak, 2005, Proceedings of the National Academy of Sciences of the United States of America.

Characterization of the folding landscape of monomeric lactose repressor: quantitative comparison of theory and experiment.

Cecilia Clementi, Payel Das, Corey J Wilson, 2005, Proceedings of the National Academy of Sciences of the United States of America.

Autism Classification Using Brain Functional Connectivity Dynamics and Machine Learning

Jenna Reinen, Ravi Tejwani, Payel Das, 2017, 1712.08041.

Towards Better Understanding of Adaptive Gradient Algorithms in Generative Adversarial Nets pdf

Xiaodong Cui, Mingrui Liu, Tianbao Yang, 2020, ICLR.

The experimental folding landscape of monomeric lactose repressor, a large two-domain protein, involves two kinetic intermediates.

Cecilia Clementi, Payel Das, Corey J Wilson, 2005, Proceedings of the National Academy of Sciences of the United States of America.

Interplay between drying and stability of a TIM barrel protein: a combined simulation-experimental study.

Ruhong Zhou, Payel Das, C. Robert Matthews, 2013, Journal of the American Chemical Society.

Single mutation induced H3N2 hemagglutinin antibody neutralization: a free energy perturbation study.

Ruhong Zhou, Payel Das, R. Zhou, 2008, The journal of physical chemistry. B.