Leela S. Dodda

icon indicating a website link https://www.linkedin.com/in/leela-sriram-dodda/

icon company Yale University icon location United States icon location Drug Discovery@NimbusTx. Previously at VantAI & SiliconTx (Roivant companies). Yale@2018.

Results 2 repositories owned by Leela S. Dodda

OPLSAA-DB

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Database of hand-built OPLS-AA parameters and topologies for 464 molecules. Zip files contains parameter and topologies for OpenMM, Gromacs, NAMD, CHARMM, LAMMPS, TINKER, CNS/X-PLOR, Q, DESMOND, BOSS...

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ligpargen

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A repository for tutorials and FAQ's about LigParGen

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