Computational design of a synthetic PD-1 agonist

Por Bryan, Cassie M., Rocklin, Gabriel J., Bick, Matthew J., Ford, Alex, Majri-Morrison, Sonia, Kroll, Ashley V., Miller, Chad J., Carter, Lauren, Goreshnik, Inna, Kang, Alex, DiMaio, Frank, Tarbell, Kristin V., Baker, David
Publicado no Proc Natl Acad Sci U S A (2021)

Protein folding by distributed computing and the denatured state ensemble

Por Marianayagam, Neelan J., Fawzi, Nicolas L., Head-Gordon, Teresa
Publicado em 2005

Machine learning classification can reduce false positives in structure-based virtual screening

Por Adeshina, Yusuf O., Deeds, Eric J., Karanicolas, John
Publicado no Proc Natl Acad Sci U S A (2020)

The NIST Automated Computer Time Service

Por Levine, J., Weiss, M., Davis, D. D., Allan, D. W., Sullivan, D. B.
Publicado no J Res Natl Inst Stand Technol (1989)

A Comparison of Methods for Computing the Residual Resistivity Ratio of High-Purity Niobium

Por Splett, J. D., Vecchia, D. F., Goodrich, L. F.
Publicado no J Res Natl Inst Stand Technol (2011)

Cooperative effects in water-biomolecule crystal systems.

Por Goodfellow, J M
Publicado em 1982

Mechanosensitivity of Jagged–Notch signaling can induce a switch-type behavior in vascular homeostasis

Por Loerakker, Sandra, Stassen, Oscar M. J. A., ter Huurne, Fleur M., Boareto, Marcelo, Bouten, Carlijn V. C., Sahlgren, Cecilia M.
Publicado no Proc Natl Acad Sci U S A (2018)

Control of protein signaling using a computationally designed GTPase/GEF orthogonal pair

Por Kapp, Gregory T., Liu, Sen, Stein, Amelie, Wong, Derek T., Reményi, Attila, Yeh, Brian J., Fraser, James S., Taunton, Jack, Lim, Wendell A., Kortemme, Tanja
Publicado em 2012

Computational design of probes to detect bacterial genomes by multivalent binding

Por Curk, Tine, Brackley, Chris A., Farrell, James D., Xing, Zhongyang, Joshi, Darshana, Direito, Susana, Bren, Urban, Angioletti-Uberti, Stefano, Dobnikar, Jure, Eiser, Erika, Frenkel, Daan, Allen, Rosalind J.
Publicado no Proc Natl Acad Sci U S A (2020)

Collective effects of XMAP215, EB1, CLASP2, and MCAK lead to robust microtubule treadmilling

Por Arpağ, Göker, Lawrence, Elizabeth J., Farmer, Veronica J., Hall, Sarah L., Zanic, Marija
Publicado no Proc Natl Acad Sci U S A (2020)

Reproductive outcomes predicted by phase imaging with computational specificity of spermatozoon ultrastructure

Por Kandel, Mikhail E., Rubessa, Marcello, He, Yuchen R., Schreiber, Sierra, Meyers, Sasha, Matter Naves, Luciana, Sermersheim, Molly K., Sell, G. Scott, Szewczyk, Michael J., Sobh, Nahil, Wheeler, Matthew B., Popescu, Gabriel
Publicado no Proc Natl Acad Sci U S A (2020)

Beating the curse of dimension with accurate statistics for the Fokker–Planck equation in complex turbulent systems

Por Chen, Nan, Majda, Andrew J.
Publicado no Proc Natl Acad Sci U S A (2017)

Engineering strategy to improve peptide analogs: from structure-based computational design to tumor homing

Por Zanuy, David, Sayago, Francisco J., Revilla-López, Guillem, Ballano, Gema, Agemy, Lilach, Kotamraju, Venkata Ramana, Jiménez, Ana I., Cativiela, Carlos, Nussinov, Ruth, Sawvel, April M., Stucky, Galen, Ruoslahti, Erkki, Alemán, Carlos
Publicado no J Comput Aided Mol Des (2012)

Emergence of analogy from relation learning

Por Lu, Hongjing, Wu, Ying Nian, Holyoak, Keith J.
Publicado no Proc Natl Acad Sci U S A (2019)

Single-molecule and in silico dissection of the interaction between Polycomb repressive complex 2 and chromatin

Por Leicher, Rachel, Ge, Eva J., Lin, Xingcheng, Reynolds, Matthew J., Xie, Wenjun, Walz, Thomas, Zhang, Bin, Muir, Tom W., Liu, Shixin
Publicado no Proc Natl Acad Sci U S A (2020)

Tight and specific lanthanide binding in a de novo TIM barrel with a large internal cavity designed by symmetric domain fusion

Por Caldwell, Shane J., Haydon, Ian C., Piperidou, Nikoletta, Huang, Po-Ssu, Bick, Matthew J., Sjöström, H. Sebastian, Hilvert, Donald, Baker, David, Zeymer, Cathleen
Publicado no Proc Natl Acad Sci U S A (2020)

Geometric anomaly detection in data

Por Stolz, Bernadette J., Tanner, Jared, Harrington, Heather A., Nanda, Vidit
Publicado no Proc Natl Acad Sci U S A (2020)

Indel-correcting DNA barcodes for high-throughput sequencing

Por Hawkins, John A., Jones, Stephen K., Finkelstein, Ilya J., Press, William H.
Publicado no Proc Natl Acad Sci U S A (2018)

Naming unrelated words predicts creativity

Por Olson, Jay A., Nahas, Johnny, Chmoulevitch, Denis, Cropper, Simon J., Webb, Margaret E.
Publicado no Proc Natl Acad Sci U S A (2021)

Fluctuating hydrogen-bond networks govern anomalous electron transfer kinetics in a blue copper protein

Por Kretchmer, Joshua S., Boekelheide, Nicholas, Warren, Jeffrey J., Winkler, Jay R., Gray, Harry B., Miller, Thomas F.
Publicado no Proc Natl Acad Sci U S A (2018)