Zobrazeno 1 - 4
of 4
pro vyhledávání: '"Bryon Tjanaka"'
Autor:
Michael K. Gilson, John D. Chodera, Bryon Tjanaka, Daniel A. Smith, Caitlin C. Bannan, Hyesu Jang, Michael R. Shirts, Yudong Qiu, Chaya D. Stern, Trevor Gokey, Lee-Ping Wang, Xavier Lucas, Victoria T. Lim, Christopher I. Bayly, David F. Hahn, Simon Boothroyd, David L. Mobley, Gary Tresadern, Andrea Rizzi, Jeffrey R. Wagner
Publikováno v:
J Chem Theory Comput
We present a methodology for defining and optimizing a general force field for classical molecular simulations, and we describe its use to derive the Open Force Field 1.0.0 small-molecule force field, codenamed Parsley. Rather than using traditional
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::52338355a022b64066c79c1a5a224008
https://europepmc.org/articles/PMC8511297/
https://europepmc.org/articles/PMC8511297/
Autor:
Mert Terzihan, Yuan Wang, Bryon Tjanaka, Manzil Zaheer, Avinava Dubey, Gokhan Mergen, Marc Najork, Yuchen Wu, Amr Ahmed, Andrew McCallum, Guru Guruganesh, Nicholas Monath
Publikováno v:
Proceedings of the 27th ACM SIGKDD Conference on Knowledge Discovery & Data Mining.
The applicability of agglomerative clustering, for inferring both hierarchical and flat clustering, is limited by its scalability. Existing scalable hierarchical clustering methods sacrifice quality for speed and often lead to over-merging of cluster
Autor:
Yudong Qiu, Daniel Smith, Simon Boothroyd, Hyesu Jang, Jeffrey Wagner, Caitlin C. Bannan, Trevor Gokey, Victoria T. Lim, Chaya Stern, Andrea Rizzi, Xavier Lucas, Bryon Tjanaka, Michael R. Shirts, Michael Gilson, John Chodera, Christopher I. Bayly, David Mobley, Lee-Ping Wang
We present a methodology for defining and optimizing a general force field for classical molecular simulations, and we describe its use to derive the Open Force Field 1.0.0 small molecule force field, code-named Parsley. Rather than traditional atom-
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::2894c07fae81a3ec8972bd475567e204
https://doi.org/10.26434/chemrxiv-2021-l070l-v4
https://doi.org/10.26434/chemrxiv-2021-l070l-v4
Publikováno v:
Robotics: Science and Systems
When studying robots collaborating with humans, much of the focus has been on robot policies that coordinate fluently with human teammates in collaborative tasks. However, less emphasis has been placed on the effect of the environment on coordination
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::49ee2684a1395c95e73ffabe9dabdf86
http://arxiv.org/abs/2106.10853
http://arxiv.org/abs/2106.10853