Andres Cisneros - Search Results

Year	Number of Results
2003	1
2004	2
2005	2
2006	5
2007	2
2008	1
2009	1
2010	2
2011	3
2012	6
2013	8
2014	8
2015	5
2016	7
2017	7
2018	12
2019	7
2020	3
2021	7
2022	9
2023	15
2024	5

1

Impact of an Ionic Liquid Solution on Horseradish Peroxidase Activity.

Chatterjee S, Nochebuena J, Cisneros GA. Chatterjee S, et al. Among authors: cisneros ga. J Am Chem Soc. 2024 May 3. doi: 10.1021/jacs.4c01100. Online ahead of print. J Am Chem Soc. 2024. PMID: 38701006

2

Relative cooperativity in neutral and charged molecular clusters using QM/MM calculations.

Nochebuena J, Liu S, Cisneros GA. Nochebuena J, et al. Among authors: cisneros ga. J Chem Phys. 2024 Apr 7;160(13):134301. doi: 10.1063/5.0203020. J Chem Phys. 2024. PMID: 38557841

3

Rapid, high-capacity adsorption of iodine from aqueous environments with amide functionalized covalent organic frameworks.

Arora N, Debnath T, Senarathna MC, Johnson RM, Roske IG, Cisneros GA, Smaldone RA. Arora N, et al. Among authors: cisneros ga. Chem Sci. 2024 Jan 24;15(10):3571-3577. doi: 10.1039/d3sc06004g. eCollection 2024 Mar 6. Chem Sci. 2024. PMID: 38455001 Free PMC article.

4

Investigation of dynamical flexibility of D5SIC-DNAM inside DNA duplex in aqueous solution: a systematic classical MD approach.

Debnath T, Cisneros GA. Debnath T, et al. Among authors: cisneros ga. Phys Chem Chem Phys. 2024 Feb 28;26(9):7435-7445. doi: 10.1039/d3cp05572h. Phys Chem Chem Phys. 2024. PMID: 38353005

5

Investigation of the stability of D5SIC-DNAM-incorporated DNA duplex in Taq polymerase binary system: a systematic classical MD approach.

Debnath T, Cisneros GA. Debnath T, et al. Among authors: cisneros ga. Phys Chem Chem Phys. 2024 Feb 28;26(9):7287-7295. doi: 10.1039/d3cp05571j. Phys Chem Chem Phys. 2024. PMID: 38353000

6

Cooperativity and Frustration Effects (or Lack Thereof) in Polarizable and Non-polarizable Force Fields.

Nochebuena J, Piquemal JP, Liu S, Cisneros GA. Nochebuena J, et al. Among authors: cisneros ga. J Chem Theory Comput. 2023 Nov 14;19(21):7715-7730. doi: 10.1021/acs.jctc.3c00762. Epub 2023 Oct 27. J Chem Theory Comput. 2023. PMID: 37888874

7

Leveraging QM/MM and Molecular Dynamics Simulations to Decipher the Reaction Mechanism of the Cas9 HNH Domain to Investigate Off-Target Effects.

Maghsoud Y, Jayasinghe-Arachchige VM, Kumari P, Cisneros GA, Liu J. Maghsoud Y, et al. Among authors: cisneros ga. J Chem Inf Model. 2023 Nov 13;63(21):6834-6850. doi: 10.1021/acs.jcim.3c01284. Epub 2023 Oct 25. J Chem Inf Model. 2023. PMID: 37877218

8

Unleashing the Potential of 1,3-Diketone Analogues as Selective LH2 Inhibitors.

Lee J, Guo HF, Wang S, Maghsoud Y, Vázquez-Montelongo EA, Jing Z, Sammons RM, Cho EJ, Ren P, Cisneros GA, Kurie JM, Dalby KN. Lee J, et al. Among authors: cisneros ga. ACS Med Chem Lett. 2023 Sep 22;14(10):1396-1403. doi: 10.1021/acsmedchemlett.3c00305. eCollection 2023 Oct 12. ACS Med Chem Lett. 2023. PMID: 37849534

9

AmberTools.

Case DA, Aktulga HM, Belfon K, Cerutti DS, Cisneros GA, Cruzeiro VWD, Forouzesh N, Giese TJ, Götz AW, Gohlke H, Izadi S, Kasavajhala K, Kaymak MC, King E, Kurtzman T, Lee TS, Li P, Liu J, Luchko T, Luo R, Manathunga M, Machado MR, Nguyen HM, O'Hearn KA, Onufriev AV, Pan F, Pantano S, Qi R, Rahnamoun A, Risheh A, Schott-Verdugo S, Shajan A, Swails J, Wang J, Wei H, Wu X, Wu Y, Zhang S, Zhao S, Zhu Q, Cheatham TE 3rd, Roe DR, Roitberg A, Simmerling C, York DM, Nagan MC, Merz KM Jr. Case DA, et al. Among authors: cisneros ga. J Chem Inf Model. 2023 Oct 23;63(20):6183-6191. doi: 10.1021/acs.jcim.3c01153. Epub 2023 Oct 8. J Chem Inf Model. 2023. PMID: 37805934 Free PMC article.

10

Molecular basis for short-chain thioester hydrolysis by acyl hydrolase domains in trans -acyltransferase polyketide synthases.

Fage CD, Passmore M, Tatman BP, Smith HG, Jian X, Dissanayake UC, Andrés Cisneros G, Challis GL, Lewandowski JR, Jenner M. Fage CD, et al. Among authors: andres cisneros g. bioRxiv [Preprint]. 2023 Aug 11:2023.08.11.552765. doi: 10.1101/2023.08.11.552765. bioRxiv. 2023. PMID: 37609184 Free PMC article. Preprint.

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