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Supercomputer-Based Ensemble Docking Drug Discovery Pipeline with Application to Covid-19.

A. Acharya, R. Agarwal, M. Baker, J. Baudry, D. Bhowmik, S. Böhm, K. Byler, S. Chen, L. Coates, C. Cooper, O. Demerdash, I. Daidone, J. Eblen, S. Ellingson, S. Forli, J. Glaser, J. Gumbart, J. Gunnels, O. Hernandez, S. Irle, D. Kneller, A. Kovalevsky, J. Larkin, T. Lawrence, S. LeGrand, S. Liu, J. Mitchell, G. Park, J. Parks, A. Pavlova, L. Petridis, D. Poole, L. Pouchard, A. Ramanathan, D. Rogers, D. Santos-Martins, A. Scheinberg, A. Sedova, Y. Shen, J. Smith, M. Smith, C. Soto, A. Tsaris, M. Thavappiragasam, A. Tillack, J. Vermaas, V. Vuong, J. Yin, S. Yoo, M. Zahran, and L. Polzi. J. Chem. Inf. Model., 60 (12): 5832-5852 (2020)

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Debsindhu Bhowmik

Swati Bhowmik

Satya Bhowmik

David Bhowmik

Sukanya Bhowmik

Other publications of authors with the same name

Dynamic Profiling of β-Coronavirus 3CL Mpro Protease Ligand-Binding Sites.E. Cho, M. Rosa, R. Anjum, S. Mehmood, M. Soban, M. Mujtaba, K. Bux, S. Moin, M. Tanweer, S. Dantu and 8 other author(s). J. Chem. Inf. Model., 61 (6): 3058-3073 (2021)Secure Collaborative Environment for Seamless Sharing of Scientific Knowledge.S. Yoginath, M. Doucet, D. Bhowmik, D. Heise, F. Alamudun, H. Yoon, and C. Stanley. SMC, volume 1512 of Communications in Computer and Information Science, page 139-156. Springer, (2021)Automating Genetic Algorithm Mutations for Molecules Using a Masked Language Model.A. Blanchard, M. Shekar, S. Gao, J. Gounley, I. Lyngaas, J. Glaser, and D. Bhowmik. IEEE Trans. Evol. Comput., 26 (4): 793-799 (2022)Computational Workflow for Accelerated Molecular Design Using Quantum Chemical Simulations and Deep Learning Models.A. Blanchard, P. Zhang, D. Bhowmik, K. Mehta, J. Gounley, S. Reeve, S. Irle, and M. Pasini. SMC, volume 1690 of Communications in Computer and Information Science, page 3-19. Springer, (2022)Transferring a molecular foundation model for polymer property predictions.P. Zhang, L. Kearney, D. Bhowmik, Z. Fox, A. Naskar, and J. Gounley. CoRR, (2023)ProtTrans: Toward Understanding the Language of Life Through Self-Supervised Learning.A. Elnaggar, M. Heinzinger, C. Dallago, G. Rehawi, Y. Wang, L. Jones, T. Gibbs, T. Feher, C. Angerer, M. Steinegger and 2 other author(s). IEEE Trans. Pattern Anal. Mach. Intell., 44 (10): 7112-7127 (2022)Towards Native Execution of Deep Learning on a Leadership-Class HPC System.S. Yoginath, M. Alam, A. Ramanathan, D. Bhowmik, N. Laanait, and K. Perumalla. IPDPS Workshops, page 941-950. IEEE, (2019)Enhancing molecular design efficiency: Uniting language models and generative networks with genetic algorithms.D. Bhowmik, P. Zhang, Z. Fox, S. Irle, and J. Gounley. Patterns, 5 (4): 100947 (2024)Supercomputer-Based Ensemble Docking Drug Discovery Pipeline with Application to Covid-19.A. Acharya, R. Agarwal, M. Baker, J. Baudry, D. Bhowmik, S. Böhm, K. Byler, S. Chen, L. Coates, C. Cooper and 41 other author(s). J. Chem. Inf. Model., 60 (12): 5832-5852 (2020)Deep Generative Model Driven Protein Folding Simulations.H. Ma, D. Bhowmik, H. Lee, M. Turilli, M. Young, S. Jha, and A. Ramanathan. PARCO, volume 36 of Advances in Parallel Computing, page 45-55. IOS Press, (2019)

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Disambiguation of "Bhowmik, Debsindhu"

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Supercomputer-Based Ensemble Docking Drug Discovery Pipeline with Application to Covid-19.

Please choose a person to relate this publication to

Debsindhu Bhowmik

Swati Bhowmik

Satya Bhowmik

David Bhowmik

Sukanya Bhowmik

Other publications of authors with the same name

Disambiguation

BibSonomy

Disambiguation of "Bhowmik, Debsindhu"

copydeleteadd this publication to your clipboardcommunity posthistory of this postURLDOIBibTeXEndNoteAPAChicagoDIN 1505HarvardMSOffice XML Supercomputer-Based Ensemble Docking Drug Discovery Pipeline with Application to Covid-19.

Please choose a person to relate this publication to

Debsindhu Bhowmik

Swati Bhowmik

Satya Bhowmik

David Bhowmik

Sukanya Bhowmik

Other publications of authors with the same name

Disambiguation

copy delete add this publication to your clipboard
community post
history of this post
URL
DOI
BibTeX
EndNote
APA
Chicago
DIN 1505
Harvard
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Supercomputer-Based Ensemble Docking Drug Discovery Pipeline with Application to Covid-19.