Rational Prediction with Molecular Dynamics for Hit Identification

por Nichols, Sara E, Swift, Robert V, Amaro, Rommie E
Publicado 2012

Free energy landscape of G-protein coupled receptors, explored by accelerated molecular dynamics

por Miao, Yinglong, Nichols, Sara E., McCammon, J. Andrew
Publicado 2014

Predictive Power of Molecular Dynamics Receptor Structures in Virtual Screening

por Nichols, Sara E., Baron, Riccardo, Ivetac, Anthony, McCammon, J. Andrew
Publicado 2011

Effects of histidine protonation and rotameric states on virtual screening of M. tuberculosis RmlC

por Kim, Meekyum Olivia, Nichols, Sara E., Wang, Yi, McCammon, J. Andrew
Publicado 2013

Identification of Potential Small Molecule Binding Pockets on Rho Family GTPases

por Ortiz-Sanchez, Juan Manuel, Nichols, Sara E., Sayyah, Jacqueline, Brown, Joan Heller, McCammon, J. Andrew, Grant, Barry J.
Publicado 2012