Results 91 to 100 of about 679,868 (186)

Understanding the formation mechanism and structural aspects of anti-cancer drug platinum uracil blue by quantum chemical studies. [PDF]

RSC Adv
Ghatak A, Banerjee S.
europepmc   +1 more source

Computational Screening of Amino-Functionalized Molecules for Direct Air Capture of CO₂. [PDF]

J Phys Chem A
Li C, Vernuccio S, Moghadam PZ.
europepmc   +1 more source

Contact Cluster Modeling of Allosteric Communication in PDZ Domains. [PDF]

J Phys Chem B
Dorbath E, Rudolf F, Gulzar A, Stock G.
europepmc   +1 more source

Quantifying State-Dependent Control Properties of Brain Dynamics from Perturbation Responses. [PDF]

J Neurosci
Shikauchi Y, Takemi M, Tomasevic L, Kitazono J, Siebner HR, Oizumi M.   +5 more
europepmc   +1 more source

Temporal power of a cycling sprinter: experiments and effective time theory. [PDF]

Proc Biol Sci
Clanet C, Sachet I, Dorel S, Cohen C, Morel B, Bowen M, Samozino P, Brunet E.   +7 more
europepmc   +1 more source

Computational Characterization of Unsupported Au(I)···Ir(I) Metallophilic Interactions: Evidence for Strong Dispersive Stabilization. [PDF]

Inorg Chem
Reboiro F, Olmos ME, López-de-Luzuriaga JM, Monge M.   +3 more
europepmc   +1 more source

Fatigue Crack Initiation Life Prediction of Rails Using Theory of Critical Distance and Critical Plane Approach

Journal of Computational Science and Technology, 2012
Makoto AKAMA, Hiroyuki MATSUDA, Hisayo DOI, Masahiro TSUJIE   +3 more
openaire   +2 more sources

[Be(NH₃)₁₆]^[2] ⁺ Microsolvation: Structure, Energetics, and Temperature Effects. [PDF]

Chemphyschem
Hattab A, Malloum A, Conradie J, Dhaouadi Z, Russo N.   +4 more
europepmc   +1 more source

Isolation and reactivity of sodium benzyl cations. [PDF]

Nat Commun
Kundu S, Raj K, Andrews AP, Rajeshkumar T, Maron L, Venugopal A.   +5 more
europepmc   +1 more source

On the Question of the Application Potential and the Molecular Mechanism of the Formation of 1,3-Diaryl-5-Nitropyrazoles from Trichloromethylated Diarylnitropyrazolines. [PDF]

Molecules
Kula K, Jasiński R.
europepmc   +1 more source