Belongs to

• Sloan Kettering Institute Faculty

Types of Work

[]

[[["Journal Articles",422],["Meeting Abstracts",111],["Conference Papers",10],["Book Sections",3]]]

[546]

Popular keywords

• animals
• article
• controlled study
• gene expression
• gene expression profiling
• human
• human cell
• mouse
• nonhuman
• priority journal

Recent Works

1. The SAMPL6 SAMPLing challenge: Assessing the reliability and efficiency of binding free energy calculations

   Journal Article

   Rizzi, A.; Jensen, T.; Slochower, D. R.; Aldeghi, M.; Gapsys, V.; Ntekoumes, D.; Bosisio, S.; Papadourakis, M.; Henriksen, N. M.; de Groot, B. L.; more...
   Journal of Computer-Aided Molecular Design (2020)

   Fulltext@MSK | Save
2. Octanol-water partition coefficient measurements for the SAMPL6 blind prediction challenge

   Journal Article

   Işık, M.; Levorse, D.; Mobley, D. L.; Rhodes, T.; Chodera, J. D.
   Journal of Computer-Aided Molecular Design (2020)

   Fulltext@MSK | Save
3. Standard state free energies, not pK(a)s, are ideal for describing small molecule protonation and tautomeric states

   Journal Article

   Gunner, M. R.; Murakami, T.; Rustenburg, A. S.; Işık, M.; Chodera, J. D.
   Journal of Computer-Aided Molecular Design (2020)

   Fulltext@MSK | Save