المؤلفون: Vilseck, Jonah Z, Armacost, Kira A, Hayes, Ryan L, Goh, Garrett B, Brooks, Charles L

المصدر: The Journal of Physical Chemistry Letters. 9(12)

مصطلحات موضوعية: HIV/AIDS, 5.1 Pharmaceuticals, Development of treatments and therapeutic interventions, Affordable and Clean Energy, Physical Sciences, Chemical Sciences

وصف الملف: application/pdf

URL الوصول: https://escholarship.org/uc/item/8kf0g1mx

المؤلفون: Hayes, Ryan L, Armacost, Kira A, Vilseck, Jonah Z, Brooks, Charles L

المصدر: The Journal of Physical Chemistry B. 121(15)

مصطلحات موضوعية: Bioengineering, Algorithms, Benzoquinones, Lactams, Macrocyclic, Molecular Dynamics Simulation, Molecular Structure, Physical Sciences, Chemical Sciences, Engineering

وصف الملف: application/pdf

URL الوصول: https://escholarship.org/uc/item/3ts2z7x5

المؤلفون: Plotkin, Michael A., Labroli, Marc, Schubert, Jeffrey, Shaw, Anthony, Schlegel, Kelly-Ann S., Berger, Richard, Cooke, Andrew J., Hayes, Robert P., Armacost, Kira A., Kinek, Keith, Krosky, Paula, Burlein, Christine, Meng, Shi, DiNunzio, Edward, Murray, Edward M., Agrawal, Sony, Madeira, Maria, Flattery, Amy, Yao, Huifang, Leithead, Andrew

المصدر: ACS Medicinal Chemistry Letters; 8/8/2024, Vol. 15 Issue 8, p1232-1241, 10p

المؤلفون: Hayes, Robert P., Heo, Mee Ra, Mason, Mark, Reid, John, Burlein, Christine, Armacost, Kira A., Tellers, David M., Raheem, Izzat, Shaw, Anthony W., Murray, Edward, McKenna, Philip M., Abeywickrema, Pravien, Sharma, Sujata, Soisson, Stephen M., Klein, Daniel

المصدر: Nature Communications ; volume 12, issue 1 ; ISSN 2041-1723

الاتاحة: http://dx.doi.org/10.1038/s41467-021-23312-8
https://www.nature.com/articles/s41467-021-23312-8.pdf
https://www.nature.com/articles/s41467-021-23312-8

المؤلفون: Hong, Chuan, Byrne, Noel J., Zamlynny, Beata, Tummala, Srivanya, Xiao, Li, Shipman, Jennifer M., Partridge, Andrea T., Minnick, Christina, Breslin, Michael J., Rudd, Michael T., Stachel, Shawn J., Rada, Vanessa L., Kern, Jeffrey C., Armacost, Kira A., Hollingsworth, Scott A., O’Brien, Julie A., Hall, Dawn L., McDonald, Terrence P., Strickland, Corey, Brooun, Alexei, Soisson, Stephen M., Hollenstein, Kaspar

المصدر: Nature Communications ; volume 12, issue 1 ; ISSN 2041-1723

الاتاحة: http://dx.doi.org/10.1038/s41467-021-21087-6
https://www.nature.com/articles/s41467-021-21087-6.pdf
https://www.nature.com/articles/s41467-021-21087-6

المؤلفون: Armacost, Kira A., Riniker, Sereina, Cournia, Zoe

المصدر: Journal of Chemical Information and Modeling ; volume 60, issue 1, page 1-5 ; ISSN 1549-9596 1549-960X

الاتاحة: http://dx.doi.org/10.1021/acs.jcim.9b01174
https://pubs.acs.org/doi/pdf/10.1021/acs.jcim.9b01174

المؤلفون: Armacost, Kira A., Riniker, Sereina, Cournia, Zoe

المصدر: Journal of Chemical Information and Modeling ; volume 60, issue 11, page 5283-5286 ; ISSN 1549-9596 1549-960X

الاتاحة: http://dx.doi.org/10.1021/acs.jcim.0c01266
https://pubs.acs.org/doi/pdf/10.1021/acs.jcim.0c01266

المؤلفون: Palermo, Giulia, Armacost, Kira A., Nagan, Maria C.

المصدر: Journal of Chemical Information and Modeling ; volume 59, issue 10, page 4061-4062 ; ISSN 1549-9596 1549-960X

الاتاحة: http://dx.doi.org/10.1021/acs.jcim.9b00643
https://pubs.acs.org/doi/pdf/10.1021/acs.jcim.9b00643

المؤلفون: Chen, Emile P., Bondi, Robert W., Zhang, Carolyn, Price, Daniel J., Ho, Ming-Hsun, Armacost, Kira A., DeMartino, Michael P.

المصدر: Journal of Medicinal Chemistry ; volume 65, issue 9, page 6926-6939 ; ISSN 0022-2623 1520-4804

الاتاحة: http://dx.doi.org/10.1021/acs.jmedchem.2c00330
https://pubs.acs.org/doi/pdf/10.1021/acs.jmedchem.2c00330

المؤلفون: Armacost, Kira A., Gladstone, Eric C., Thompson, David C.

المصدر: ACS Symposium Series ; Free Energy Methods in Drug Discovery: Current State and Future Directions ; page 267-287 ; ISSN 0097-6156 1947-5918 ; ISBN 9780841298064 9780841298057

الاتاحة: http://dx.doi.org/10.1021/bk-2021-1397.ch011
https://pubs.acs.org/doi/pdf/10.1021/bk-2021-1397.ch011

المؤلفون: Armacost, Kira A., Goh, Garrett B., Brooks, Charles L.

المصدر: Biophysical Journal ; volume 108, issue 2, page 356a ; ISSN 0006-3495

الاتاحة: http://dx.doi.org/10.1016/j.bpj.2014.11.1951
https://api.elsevier.com/content/article/PII:S0006349514031634?httpAccept=text/xml
https://api.elsevier.com/content/article/PII:S0006349514031634?httpAccept=text/plain

المؤلفون: Thompson, David, Armacost, Kira, Gladstone, Eric C.

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::16fa99a2be75651e3ca285ae795cab27

المؤلفون: Thompson, David, Armacost, Kira, Gladstone, Eric C.

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::2ae40ad5cf8f3f186b27928d221ed16f

المؤلفون: Won, Sang Joon, Davda, Dahvid, Labby, Kristin J., Hwang, Sin Ye, Pricer, Rachel, Majmudar, Jaimeen D., Armacost, Kira A., Rodriguez, Laura A., Rodriguez, Christina L., Chong, Fei San, Torossian, Kristopher A., Palakurthi, Jasmine, Hur, Edward S., Meagher, Jennifer L., Brooks, Charles L., Stuckey, Jeanne A., Martin, Brent R.

مصطلحات موضوعية: 37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CHEMISTRY

وصف الملف: application/pdf

Relation: http://www.osti.gov/servlets/purl/1339742; https://www.osti.gov/biblio/1339742; https://doi.org/10.1021/acschembio.6b00720

الاتاحة: http://www.osti.gov/servlets/purl/1339742
https://www.osti.gov/biblio/1339742
https://doi.org/10.1021/acschembio.6b00720

المؤلفون: Armacost, Kira A.

المصدر: Journal of Chemical Information and Modeling ; volume 58, issue 6, page 1161-1163 ; ISSN 1549-9596 1549-960X

الاتاحة: http://dx.doi.org/10.1021/acs.jcim.8b00262
https://pubs.acs.org/doi/pdf/10.1021/acs.jcim.8b00262

المؤلفون: Fradera, Xavier, Verras, Andreas, Hu, Yuan, Wang, Deping, Wang, Hongwu, Fells, James I., Armacost, Kira A., Crespo, Alejandro, Sherborne, Brad, Wang, Huijun, Peng, Zhengwei, Gao, Ying-Duo

المصدر: Journal of Computer-Aided Molecular Design ; volume 32, issue 1, page 113-127 ; ISSN 0920-654X 1573-4951

الاتاحة: http://dx.doi.org/10.1007/s10822-017-0053-2
http://link.springer.com/article/10.1007/s10822-017-0053-2/fulltext.html
http://link.springer.com/content/pdf/10.1007/s10822-017-0053-2.pdf

المؤلفون: Gao, Ying-Duo, Hu, Yuan, Crespo, Alejandro, Wang, Deping, Armacost, Kira A., Fells, James I., Fradera, Xavier, Wang, Hongwu, Wang, Huijun, Sherborne, Brad, Verras, Andreas, Peng, Zhengwei

المصدر: Journal of Computer-Aided Molecular Design ; volume 32, issue 1, page 129-142 ; ISSN 0920-654X 1573-4951

الاتاحة: http://dx.doi.org/10.1007/s10822-017-0072-z
http://link.springer.com/article/10.1007/s10822-017-0072-z/fulltext.html
http://link.springer.com/content/pdf/10.1007/s10822-017-0072-z.pdf

المؤلفون: Soteras Gutiérrez, Ignacio, Lin, Fang-Yu, Vanommeslaeghe, Kenno, Lemkul, Justin A., Armacost, Kira A., Brooks, Charles L., MacKerell, Alexander D.

المصدر: Bioorganic & Medicinal Chemistry ; volume 24, issue 20, page 4812-4825 ; ISSN 0968-0896

الاتاحة: http://dx.doi.org/10.1016/j.bmc.2016.06.034
https://api.elsevier.com/content/article/PII:S0968089616304576?httpAccept=text/xml
https://api.elsevier.com/content/article/PII:S0968089616304576?httpAccept=text/plain

المؤلفون: Armacost, Kira A., Goh, Garrett B., Brooks, Charles L.

المساهمون: Howard Hughes Medical Institute, National Institute of General Medical Sciences

المصدر: Journal of Chemical Theory and Computation ; volume 11, issue 3, page 1267-1277 ; ISSN 1549-9618 1549-9626

الاتاحة: http://dx.doi.org/10.1021/ct500894k
https://pubs.acs.org/doi/pdf/10.1021/ct500894k

المؤلفون: Armacost, Kira, Musila, Jonathan, Gathiaka, Symon, Ellis, Holly R., Acevedo, Orlando

المساهمون: National Science Foundation

المصدر: Biochemistry ; volume 53, issue 20, page 3308-3317 ; ISSN 0006-2960 1520-4995

الاتاحة: http://dx.doi.org/10.1021/bi5002085
https://pubs.acs.org/doi/pdf/10.1021/bi5002085