المؤلفون: Polêto, Marcelo D., Lemkul, Justin A.

المساهمون: National Institute of Food and Agriculture, National Institute of General Medical Sciences

المصدر: Macromolecules ; volume 58, issue 1, page 403-414 ; ISSN 0024-9297 1520-5835

الاتاحة: https://doi.org/10.1021/acs.macromol.4c02109
https://pubs.acs.org/doi/pdf/10.1021/acs.macromol.4c02109

المؤلفون: Polêto, Marcelo D., Allen, Kylie D., Lemkul, Justin A.

المساهمون: Basic Energy Sciences

المصدر: Biochemistry ; volume 63, issue 14, page 1783-1794 ; ISSN 0006-2960 1520-4995

الاتاحة: http://dx.doi.org/10.1021/acs.biochem.4c00168
https://pubs.acs.org/doi/pdf/10.1021/acs.biochem.4c00168

المؤلفون: Giacon, Noah, Lo Cascio, Ettore, Davidson, Darcy S., Polêto, Marcelo D., Lemkul, Justin A., Pennacchietti, Valeria, Pagano, Livia, Zamparelli, Carlotta, Toto, Angelo, Arcovito, Alessandro

المساهمون: Giacon, Noah, Lo Cascio, Ettore, Davidson, Darcy S., Polêto, Marcelo D., Lemkul, Justin A., Pennacchietti, Valeria, Pagano, Livia, Zamparelli, Carlotta, Toto, Angelo, Arcovito, Alessandro

مصطلحات موضوعية: SARS-CoV-2 E protein, human ZO1-PDZ2 domain, DRUDE force field, molecular dynamic, surface plasmon resonance, folding upon binding

Relation: info:eu-repo/semantics/altIdentifier/pmid/37293240; info:eu-repo/semantics/altIdentifier/wos/WOS:001020735300001; volume:21; firstpage:3259; lastpage:3271; numberofpages:13; journal:COMPUTATIONAL AND STRUCTURAL BIOTECHNOLOGY JOURNAL; https://hdl.handle.net/11573/1682765; info:eu-repo/semantics/altIdentifier/scopus/2-s2.0-85161275182

الاتاحة: https://hdl.handle.net/11573/1682765
https://doi.org/10.1016/j.csbj.2023.05.027

المؤلفون: Poleto, Marcelo D., Lemkul, Justin A.

مصطلحات موضوعية: Telomere, DNA, RNA, G-Quadruplexes, Molecular Dynamics Simulation

وصف الملف: Pages 6851-6862; 12 page(s); application/pdf

Relation: https://www.ncbi.nlm.nih.gov/pubmed/37847037; 21 (Article number); https://hdl.handle.net/10919/117575; https://doi.org/10.1021/acs.jcim.3c01305; 63; 21; Lemkul, Justin [0000-0001-6661-8653]; Depolo Poleto, Marcelo [0000-0001-9210-690X]

الاتاحة: https://hdl.handle.net/10919/117575
https://doi.org/10.1021/acs.jcim.3c01305

المؤلفون: Polêto, Marcelo D., Lemkul, Justin A.

المصدر: Biophysical Journal ; volume 122, issue 3, page 446a ; ISSN 0006-3495

الاتاحة: http://dx.doi.org/10.1016/j.bpj.2022.11.2405
https://api.elsevier.com/content/article/PII:S0006349522033215?httpAccept=text/xml
https://api.elsevier.com/content/article/PII:S0006349522033215?httpAccept=text/plain

المؤلفون: Polêto, Marcelo D., Lemkul, Justin A.

المصدر: Macromolecules; January 2025, Vol. 58 Issue: 1 p403-414, 12p

المؤلفون: Polêto, Marcelo D., Lemkul, Justin A.

مصطلحات موضوعية: electric field, electrostatics, force fields, molecular dynamics, molecular mechanics, PARTICLE MESH EWALD, DYNAMICS SIMULATIONS, ELECTROSTATIC FIELDS, CATALYSIS, SITES, POWER, Bioengineering, Electricity, Kinetics, Molecular Dynamics Simulation

وصف الملف: Pages 1113-1119; 7 page(s); application/pdf

Relation: http://gateway.webofknowledge.com/gateway/Gateway.cgi?GWVersion=2&SrcApp=PARTNER_APP&SrcAuth=LinksAMR&KeyUT=WOS:000785574800001&DestLinkType=FullRecord&DestApp=ALL_WOS&UsrCustomerID=930d57c9ac61a043676db62af60056c1; http://hdl.handle.net/10919/113151; https://doi.org/10.1002/jcc.26873; 43; 16; Lemkul, Justin [0000-0001-6661-8653]

الاتاحة: http://hdl.handle.net/10919/113151
https://doi.org/10.1002/jcc.26873

المؤلفون: Polêto, Marcelo D., Lemkul, Justin A.

مصطلحات موضوعية: Biophysical chemistry, Molecular dynamics

وصف الملف: application/pdf

Relation: Polêto, M.D., Lemkul, J.A. Integration of experimental data and use of automated fitting methods in developing protein force fields. Commun Chem 5, 38 (2022). https://doi.org/10.1038/s42004-022-00653-z; http://hdl.handle.net/10919/109363; https://doi.org/10.1038/s42004-022-00653-z

الاتاحة: http://hdl.handle.net/10919/109363
https://doi.org/10.1038/s42004-022-00653-z

المؤلفون: Gil Pineda, Laura I., Davidson, Darcy S., Polêto, Marcelo D., Lemkul, Justin A.

المصدر: Biophysical Journal ; volume 121, issue 3, page 526a-527a ; ISSN 0006-3495

الاتاحة: http://dx.doi.org/10.1016/j.bpj.2021.11.2773
https://api.elsevier.com/content/article/PII:S0006349521037486?httpAccept=text/xml
https://api.elsevier.com/content/article/PII:S0006349521037486?httpAccept=text/plain

المؤلفون: Polêto, Marcelo D., Lemkul, Justin A.

المصدر: Biophysical Journal ; volume 121, issue 3, page 67a ; ISSN 0006-3495

الاتاحة: http://dx.doi.org/10.1016/j.bpj.2021.11.2401
https://api.elsevier.com/content/article/PII:S0006349521033762?httpAccept=text/xml
https://api.elsevier.com/content/article/PII:S0006349521033762?httpAccept=text/plain

المؤلفون: Polêto, Marcelo D., Allen, Kylie D., Lemkul, Justin A.

المصدر: Biochemistry; 7/16/2024, Vol. 63 Issue 14, p1783-1794, 12p

المؤلفون: Polêto, Marcelo D., Lemkul, Justin A.

المصدر: Biophysical Journal ; volume 123, issue 3, page 137a ; ISSN 0006-3495

الاتاحة: http://dx.doi.org/10.1016/j.bpj.2023.11.946
https://api.elsevier.com/content/article/PII:S0006349523016466?httpAccept=text/xml
https://api.elsevier.com/content/article/PII:S0006349523016466?httpAccept=text/plain

المؤلفون: Farrokhpoor, Sam, Michel, Haley, Polêto, Marcelo D., Lemkul, Justin A.

المصدر: Biophysical Journal ; volume 123, issue 3, page 423a ; ISSN 0006-3495

الاتاحة: http://dx.doi.org/10.1016/j.bpj.2023.11.2571
https://api.elsevier.com/content/article/PII:S0006349523032721?httpAccept=text/xml
https://api.elsevier.com/content/article/PII:S0006349523032721?httpAccept=text/plain

المؤلفون: de Oliveira, André S., Gazolla, Poliana A. R., Oliveira, Ana Flávia C. da S., Pereira, Wagner L., de S. Viol, Lívia C., Maia, Angélica F. da S., Santos, Edjon G., da Silva, Ítalo E. P., Mendes, Tiago A. de Oliveira, da Silva, Adalberto M., Dias, Roberto S., da Silva, Cynthia C., Polêto, Marcelo D., Teixeira, Róbson R., de Paula, Sergio O.

المساهمون: Andrei, Graciela, Conselho Nacional de Desenvolvimento Científico e Tecnológico, Fundação de Amparo à Pesquisa do Estado de Minas Gerais

المصدر: PLOS ONE ; volume 14, issue 9, page e0223017 ; ISSN 1932-6203

الاتاحة: http://dx.doi.org/10.1371/journal.pone.0223017
http://dx.plos.org/10.1371/journal.pone.0223017

المؤلفون: Polêto, Marcelo D., Alves, Maura P., Ligabue-Braun, Rodrigo, Eller, Monique R., De carvalho, Antonio Fernandes

المساهمون: Coordenação de Aperfeiçoamento de Pessoal de Nível Superior, Fundação de Amparo à Pesquisa do Estado do Rio Grande do Sul, Conselho Nacional de Desenvolvimento Científico e Tecnológico, Fundação de Amparo à Pesquisa do Estado de Minas Gerais

المصدر: Food Chemistry ; volume 286, page 309-315 ; ISSN 0308-8146

الاتاحة: http://dx.doi.org/10.1016/j.foodchem.2019.01.204
https://api.elsevier.com/content/article/PII:S0308814619302961?httpAccept=text/xml
https://api.elsevier.com/content/article/PII:S0308814619302961?httpAccept=text/plain

المؤلفون: Polêto, Marcelo D., Lemkul, Justin A.

Relation: https://www.biorxiv.org/content/10.1101/2023.08.10.552810v1; https://doi.org/10.5281/zenodo.8252745; https://doi.org/10.5281/zenodo.8252746; oai:zenodo.org:8252746

الاتاحة: https://doi.org/10.5281/zenodo.8252746

المؤلفون: Fischer, Nina M., Poleto, Marcelo D., Steuer, Jakob, van der Spoel, David

مصطلحات موضوعية: Structural Biology, Strukturbiologi, Biochemistry and Molecular Biology, Biokemi och molekylärbiologi

وصف الملف: application/pdf

Relation: Nucleic Acids Research, 0305-1048, 2018, 46:10, s. 4872-4882; PMID 29718375; ISI:000438329100009

الاتاحة: http://urn.kb.se/resolve?urn=urn:nbn:se:uu:diva-360542
https://doi.org/10.1093/nar/gky221

المؤلفون: Polêto, Marcelo D., Rusu, Victor H., Grisci, Bruno I., Dorn, Marcio, Lins, Roberto D., Verli, Hugo

المساهمون: Coordenação de Aperfeiçoamento de Pessoal de Nível Superior, Fundação de Amparo à Pesquisa do Estado do Rio Grande do Sul, Conselho Nacional de Desenvolvimento Científico e Tecnológico

المصدر: Frontiers in Pharmacology ; volume 9 ; ISSN 1663-9812

الاتاحة: http://dx.doi.org/10.3389/fphar.2018.00395
http://journal.frontiersin.org/article/10.3389/fphar.2018.00395/full

المؤلفون: Polêto, Marcelo D., Lemkul, Justin A.

مصطلحات الفهرس: Biophysical chemistry, Molecular dynamics, Article - Refereed

URL: http://hdl.handle.net/10919/109363

المؤلفون: Polêto, Marcelo D., Lemkul, Justin A.

مصطلحات الفهرس: electric field, electrostatics, force fields, molecular dynamics, molecular mechanics, PARTICLE MESH EWALD, DYNAMICS SIMULATIONS, ELECTROSTATIC FIELDS, CATALYSIS, SITES, POWER, Bioengineering, Electricity, Kinetics, Molecular Dynamics Simulation, Article - Refereed

URL: http://hdl.handle.net/10919/113151