Zobrazeno 1 - 3
of 3
pro vyhledávání: '"John K, Kenna"'
Autor:
Matthew N. Bahr, Aakankschit Nandkeolyar, Mehtap Işık, David L. Mobley, Luigi Da Vià, Neysa Nevins, John D. Chodera, John K. Kenna
Publikováno v:
J Comput Aided Mol Des
The goal of the SAMPL (Statistical Assessment of the Modeling of Proteins and Ligands) challenge is to improve the accuracy of current computational models to estimate free energy of binding, deprotonation, distribution and other associated physical
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::7ebd50748fbbc42eba3c4892df8ff4b1
https://doi.org/10.26434/chemrxiv-2021-8gd90
https://doi.org/10.26434/chemrxiv-2021-8gd90
Autor:
Pamela A. Haile, Linda N. Casillas, Bartholomew J. Votta, Gren Z. Wang, Adam K. Charnley, Xiaoyang Dong, Michael J. Bury, Joseph J. Romano, John F. Mehlmann, Bryan W. King, Karl F. Erhard, Charles R. Hanning, David B. Lipshutz, Biva M. Desai, Carol A. Capriotti, Michelle C. Schaeffer, Scott B. Berger, Mukesh K. Mahajan, Michael A. Reilly, Rakesh Nagilla, Elizabeth J. Rivera, Helen H. Sun, John K. Kenna, Allison M. Beal, Michael T. Ouellette, Mike Kelly, Gillian Stemp, Máire A. Convery, Anna Vossenkämper, Thomas T. MacDonald, Peter J. Gough, John Bertin, Robert W. Marquis
Publikováno v:
Journal of Medicinal Chemistry. 62:6482-6494
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::eaccf9e5808f38c133e85649c11ad3f1
https://doi.org/10.1021/acs.jmedchem.9b00575
https://doi.org/10.1021/acs.jmedchem.9b00575
Autor:
Pamela A, Haile, Linda N, Casillas, Bartholomew J, Votta, Gren Z, Wang, Adam K, Charnley, Xiaoyang, Dong, Michael J, Bury, Joseph J, Romano, John F, Mehlmann, Bryan W, King, Karl F, Erhard, Charles R, Hanning, David B, Lipshutz, Biva M, Desai, Carol A, Capriotti, Michelle C, Schaeffer, Scott B, Berger, Mukesh K, Mahajan, Michael A, Reilly, Rakesh, Nagilla, Elizabeth J, Rivera, Helen H, Sun, John K, Kenna, Allison M, Beal, Michael T, Ouellette, Mike, Kelly, Gillian, Stemp, Máire A, Convery, Anna, Vossenkämper, Thomas T, MacDonald, Peter J, Gough, John, Bertin, Robert W, Marquis
Publikováno v:
Journal of medicinal chemistry. 62(14)
RIP2 kinase has been identified as a key signal transduction partner in the NOD2 pathway contributing to a variety of human pathologies, including immune-mediated inflammatory diseases. Small-molecule inhibitors of RIP2 kinase or its signaling partne
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=pmid________::ceb97ed99e9c95859d4d1b3bee6fd6c8
https://pubmed.ncbi.nlm.nih.gov/31265286
https://pubmed.ncbi.nlm.nih.gov/31265286