Zobrazeno 1 - 6
of 6
pro vyhledávání: '"Martin Amezcua"'
Publikováno v:
Journal of computer-aided molecular design, vol 36, iss 10
The SAMPL series of challenges aim to focus the community on specific modeling challenges, while testing and hopefully driving progress of computational methods to help guide pharmaceutical drug discovery. In this study, we report on the results of t
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::b8b73eb2efbd2c259c5f9df4dbe84ecd
https://pubmed.ncbi.nlm.nih.gov/36229622
https://pubmed.ncbi.nlm.nih.gov/36229622
Autor:
Martin Amezcua, Ricardo S. Cruz, Alex Ku, Wilfred Moran, Marcos E. Ortega, Nicholas T. Salzameda
Publikováno v:
Toxicon. 214:S4
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::ba4be38e925662eb61600a0ae00daa3f
https://doi.org/10.1016/j.toxicon.2021.11.017
https://doi.org/10.1016/j.toxicon.2021.11.017
Autor:
Marcos E. Ortega, Alex Ku, Wilfred Moran, Martin Amezcua, Nicholas T. Salzameda, Ricardo Saul Cruz
Publikováno v:
ACS Med Chem Lett
[Image: see text] The botulinum neurotoxin, the caustic agent that causes botulism, is the most lethal toxin known to man. The neurotoxin composed of a heavy chain (HC) and a light chain (LC) enters neurons and cleaves SNARE proteins, leading to flac
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::927bbf77dd0c2ebbc5b5a0858995ced9
https://pubmed.ncbi.nlm.nih.gov/33603978
https://pubmed.ncbi.nlm.nih.gov/33603978
Autor:
David L. Mobley, Martin Amezcua
The SAMPL challenges focus on testing and driving progress of computational methods to help guide pharmaceutical drug discovery. However, assessment of methods for predicting binding affinities is often hampered by computational challenges such as co
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::8cdb03b7198cca391dbe0b0fa99fef56
https://doi.org/10.26434/chemrxiv.12768353.v1
https://doi.org/10.26434/chemrxiv.12768353.v1
Publikováno v:
J Comput Aided Mol Des
Journal of computer-aided molecular design, vol 35, iss 1
Journal of computer-aided molecular design, vol 35, iss 1
The SAMPL challenges focus on testing and driving progress of computational methods to help guide pharmaceutical drug discovery. However, assessment of methods for predicting binding affinities is often hampered by computational challenges such as co
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::65797ae252746ef397e3b3f017a25239
https://pubmed.ncbi.nlm.nih.gov/33392951
https://pubmed.ncbi.nlm.nih.gov/33392951
Autor:
Alejandra Y. Palomino, Thanh Lien, Jordan C. Thompson, Martin Amezcua, Sandra L. Rodriguez-Beltran, Alex Ku, Nicholas T. Salzameda, Wendy T. Dao
Publikováno v:
Bioorganicmedicinal chemistry. 28(18)
The botulinum neurotoxin (BoNT) is the most lethal protein known to man causing the deadly disease botulinum. The neurotoxin, composed of a heavy (HC) and light (LC) chain, work in concert to cause muscle paralysis. A therapeutic strategy to treat in
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::5be47b7de2660d75201a2296e5d075e8
https://pubmed.ncbi.nlm.nih.gov/32828426
https://pubmed.ncbi.nlm.nih.gov/32828426