Suchergebnisse - "Shukla, Manoj"

PubPharm (9)

1

Preferential Adsorption of Prominent Amino Acids in the Urease Enzyme of Sporosarcina pasteurii on Arid Soil Components : A Periodic DFT Study

enthalten in: Langmuir : the ACS journal of surfaces and colloids | 2022

von Pisani, W. | Jenness, G. | Schutt, T. | +2

2

Properties and Mechanisms for PFAS Adsorption to Aqueous Clay and Humic Soil Components

enthalten in: Environmental science & technology | 2022

von Luft, C. | Schutt, T. | Shukla, M.

3

Effect of Concrete Composition on the Thermodynamic Binding of Dopamine : A DFT Study

enthalten in: Langmuir : the ACS journal of surfaces and colloids | 2022

von Jenness, G. | Shukla, M.

4

In Silico Alkaline Hydrolysis of Octahydro-1,3,5,7-tetranitro-1,3,5,7-tetrazocine : Density Functional Theory Investigation

enthalten in: Environmental science & technology | 2016

von Sviatenko, L. | Gorb, L. | Hill, F. | +5

5

Novel enhanced applications of QSPR models : Temperature dependence of aqueous solubility

enthalten in: Journal of computational chemistry | 2016

von Klimenko, K. | Kuz'min, V. | Ognichenko, L. | +7

6

Experimental and computational study of membrane affinity for selected energetic compounds

enthalten in: Chemosphere | 2016

von Golius, A. | Gorb, L. | Michalkova Scott, A. | +5

7

Adsorption of 2,4,6,8,10,12-hexanitro-2,4,6,8,10,12-hexaazaisowurtzitane (CL-20) on a soil organic matter. A DFT M05 computational study

enthalten in: Chemosphere | 2016

von Sviatenko, L. | Gorb, L. | Shukla, M. | +3

8

Theoretical investigation of electronic structures and properties of C60-gold nanocontacts

enthalten in: ACS nano | 2008

von Shukla, M. | Dubey, M. | Leszczynski, J.

9

Theoretical model of the aqua-copper [Cu(H2O)5]+ cation interactions with guanine

enthalten in: Journal of molecular modeling | 2005

von Burda, J. | Shukla, M. | Leszczynski, J.

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