Asymmetric Breathing Motions of Nucleosomal DNA and the Role of Histone Tails
Kaushik Chakraborty and Sharon M. Loverde. Asymmetric Breathing Motions of Nucleosomal DNA and the Role of Histone Tails. Journal of Chemical Physics, 2017 […]
Molecular Simulations of Peptide Amphiphiles
Anjela Manandhar, Myungshim Kang, Kaushik Chakraborty, Phu Tang, and Sharon M. Loverde. Molecular Simulations of Peptide Amphiphiles. Organic and Biomolecular Chemistry, 2017, 15, 7993-8005 […]
Coarse-grained molecular dynamics studies of the structure and stability of peptide-based drug amphiphile filaments
Myungshim Kang, Honggang Cui, and Sharon M. Loverde. Coarse-grained molecular dynamics studies of the structure and stability of peptide-based drug amphiphile filaments. Soft Matter, 2017, 13, 7721-7730 […]
Kinetic model for the activation of mammalian olfactory receptor
Seogjoo Jang and Changbong Hyeon. Kinetic model for the activation of mammalian olfactory receptor. Journal of Physical Chemistry B, 2017, 121, 1304 […]
Non-uniqueness of quantum transition state theory and general dividing surfaces in the path integral space
Seogjoo Jang and Gregory A. Voth. Non-uniqueness of quantum transition state theory and general dividing surfaces in the path integral space. Journal of Chemical Physics, 2017, 146, 174106 […]
Artificial molecular motors
S. Kassem, T. van Leeuwen, A. S. Lubbe, M. R. Wilson, B. L. Feringa and D. A. Leigh, Artificial molecular motors, Chem. Soc. Rev., 2017, 46, 2592-2621. […]
Stereodivergent Synthesis with a Programmable Molecular Machine
S. Kassem, Alan T. L. Lee, David A. Leigh, Vanesa Marcos, Leoni I. Palmer and Simone Pisano, Stereodivergent Synthesis with a Programmable Molecular Machine, Nature, 2017, 549, 374-378. […]
Using Technology To Flip and Structure General Chemistry Courses at a Large Public University: Our Approach, Experience, and Outcomes
M.A. Deri, P. Mills, and D. McGregor, Using Technology To Flip and Structure General Chemistry Courses at a Large Public University: Our Approach, Experience, and Outcomes, in Teaching and the […]
Stability of Molecular Hydrogen: A Path Integral Monte Carlo Study
B. Nguyen, A. Cruz, D. McGregor, and G.E. Lopez, Stability of Molecular Hydrogen: A Path Integral Monte Carlo Study, Physics Letters A, 2017, 381, 4, 298-300. […]
Assessing the accuracy of across-the scale methods for predicting carbohydrate conformational energies on the example of glucose and a-maltose
M. Marianski, A. Supady, T. Ingram, M. Schneider and C. Baldauf, Assessing the accuracy of across-the scale methods for predicting carbohydrate conformational energies on the example of glucose and a-maltose, […]