Sasmal S - Search Results

1

Reaction Coordinates for Conformational Transitions Using Linear Discriminant Analysis on Positions.

Sasmal S, McCullagh M, Hocky GM. Sasmal S, et al. J Chem Theory Comput. 2023 Jul 25;19(14):4427-4435. doi: 10.1021/acs.jctc.3c00051. Epub 2023 May 2. J Chem Theory Comput. 2023. PMID: 37130367 Free PMC article.

2

Assessment of chemistry knowledge in large language models that generate code.

White AD, Hocky GM, Gandhi HA, Ansari M, Cox S, Wellawatte GP, Sasmal S, Yang Z, Liu K, Singh Y, Peña Ccoa WJ. White AD, et al. Among authors: sasmal s. Digit Discov. 2023 Jan 26;2(2):368-376. doi: 10.1039/d2dd00087c. eCollection 2023 Apr 11. Digit Discov. 2023. PMID: 37065678 Free PMC article.

3

Quantifying Unbiased Conformational Ensembles from Biased Simulations Using ShapeGMM.

Sasmal S, Pal T, Hocky GM, McCullagh M. Sasmal S, et al. J Chem Theory Comput. 2024 May 14;20(9):3492-3502. doi: 10.1021/acs.jctc.4c00223. Epub 2024 Apr 25. J Chem Theory Comput. 2024. PMID: 38662196 Free PMC article.

4

Good Rates From Bad Coordinates: The Exponential Average Time-dependent Rate Approach.

Mazzaferro N, Sasmal S, Cossio P, Hocky GM. Mazzaferro N, et al. Among authors: sasmal s. J Chem Theory Comput. 2024 Jul 23;20(14):5901-5912. doi: 10.1021/acs.jctc.4c00425. Epub 2024 Jul 2. J Chem Theory Comput. 2024. PMID: 38954555 Free PMC article.

5

Unbounded Sharing of Nonlocality Using Qubit Projective Measurements.

Sasmal S, Kanjilal S, Pan AK. Sasmal S, et al. Phys Rev Lett. 2024 Oct 25;133(17):170201. doi: 10.1103/PhysRevLett.133.170201. Phys Rev Lett. 2024. PMID: 39530810

6

Synthesis, Structure and Properties of Compounds Derived from Kotoite-related Structures: A₂MB₂O₆ (A=Zn, Ba, Pb; B=Pb, Ba, Zn, Cu).

Sasmal S, Devarajan N, Natarajan S. Sasmal S, et al. Chem Asian J. 2024 Nov 7:e202400868. doi: 10.1002/asia.202400868. Online ahead of print. Chem Asian J. 2024. PMID: 39508289

7

Paradigms for Behavioral Assessment in Drosophila Model of Autism Spectrum Disorder.

Dey S, Mondal P, Mandal S, Sasmal S, Chakraborty N, Das A. Dey S, et al. Among authors: sasmal s. J Vis Exp. 2024 Sep 6;(211). doi: 10.3791/66649. J Vis Exp. 2024. PMID: 39311573

8

En-bloc resection of non-muscle invasive urinary bladder tumors using low power Holmium laser-A new promise.

Choudhury S, Ahmed S, Sasmal S, Patel P. Choudhury S, et al. Among authors: sasmal s. Urologia. 2024 Sep 4:3915603241277914. doi: 10.1177/03915603241277914. Online ahead of print. Urologia. 2024. PMID: 39230520

9

Ultrasonic wave characteristics in multiscale cementitious materials at different stages of hydration.

Basu S, Sasmal S, Kundu T. Basu S, et al. Among authors: sasmal s. Ultrasonics. 2024 Aug;142:107397. doi: 10.1016/j.ultras.2024.107397. Epub 2024 Jul 3. Ultrasonics. 2024. PMID: 38986247

10

Materials descriptors for advanced water dissociation catalysts in bipolar membranes.

Sasmal S, Chen L, Sarma PV, Vulpin OT, Simons CR, Wells KM, Spontak RJ, Boettcher SW. Sasmal S, et al. Nat Mater. 2024 Oct;23(10):1421-1427. doi: 10.1038/s41563-024-01943-8. Epub 2024 Jul 1. Nat Mater. 2024. PMID: 38951650

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