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Kalyan Modugula
Kalyan Modugula
Drug discovery
Physics
Ligand field theory
Nanotechnology
Force field (physics)
2
Papers
7
Citations
0
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General Theory of Fragment Linking in Molecular Design: Why Fragment Linking Rarely Succeeds and How to Improve Outcomes.
2021
Journal of Chemical Theory and Computation
Haoyu S. Yu
Kalyan Modugula
Osamu Ichihara
Kimberly Kramschuster
Simon Keng
Robert Abel
Lingle Wang
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Citations (3)
Advancing Free Energy Calculations of Metalloenzyme in Drug Discovery via Implementation of LFMM Potentials.
2020
Journal of Chemical Theory and Computation
Steven Dajnowicz
Delaram Ghoreishi
Kalyan Modugula
Wolfgang Damm
Edward Harder
Robert Abel
Lingle Wang
Haoyu S. Yu
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Citations (4)
1