🏠
Working from home
Scientist II - Computational Chemistry
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PTC Therapeutics, Inc.
- Princeton, NJ
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11:29
(UTC -04:00) - http://www.carlosborca.com
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CrystaLattE
CrystaLattE PublicSet of scripts to automate the calculation of crystal lattice energies.
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NameDaTaken
NameDaTaken PublicAuto-rename media according to their creation date and time à la Dropbox
Python
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libefp
libefp PublicForked from ilyak/libefp
Parallel implementation of the Effective Fragment Potential Method
C
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Smiles4Psi
Smiles4Psi PublicAutomated conformational search with a genetic algorithm interfaced with a Psi4-input generator for conformers that requires only SMILES as input
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