Search Result "theoretical calculations"


Research Article

Theoretical Values, Percentage Deviations and Calculated Values by Polynomials Equation’s of The liquid Mixture with Equimolar mixture of Ethanol and Formamide.

Journal: Current Physical Chemistry
Volume: 10 Issue: 0 Year: 2020 Page: 1-14
Author(s): Ritesh Yadav,Vivekanand Mishra,Bhavya Salvi,Bhavi Patel

Quantum Chemical Methods for Calculation of Non-Covalent Interactions in Biological Molecules

Journal: Current Physical Chemistry
Volume: 2 Issue: 4 Year: 2012 Page: 314-323
Author(s): Sarah Aldulaijan,James A. Platts

An Efficient Synthetic Method and Theoretical Calculations of Olmesartan Methyl Ether: Study of Biological Function of AT1 Antagonism

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 17 Issue: 8 Year: 2014 Page: 652-662
Author(s): Dimitrios Ntountaniotis,George Agelis,Amalia Resvani,Maria Halabalaki,George Liapakis,Katerina Spyridaki,Simona Golic Grdadolnik,Franci Merzel,Sarantos Kostidis,Constantinos Potamitis,Theodore Tselios,John Matsoukas,Leandros Alexios Skaltsounis,Thomas Mavromoustakos

Theoretical Simulations of Scanning Probe Microscopy for Organic and Inorganic Materials

Journal: Current Nanoscience
Volume: 3 Issue: 1 Year: 2007 Page: 57-62
Author(s): M. Tsukada, K. Tagami, Q. Gao, N. Watanabe

Theoretical Evaluation and Classifications of Potential Antimalarial Phenazine Compounds

Journal: Letters in Organic Chemistry
Volume: 8 Issue: 1 Year: 2011 Page: 752-762
Author(s): Tania M.B. e Silva, Nely T.V. Cerqueira, Sheyla W.D. Silva, Felipe de M. Santos, Terezinha F. Oliveira, Roberta L. Ziolli, Carlton A. Taft

Research Article

TagDict: Prediction of Theoretical Spectra of Peptides Based on A Tag Dictionary

Journal: Current Bioinformatics
Volume: 13 Issue: 5 Year: 2018 Page: 444-449
Author(s): Yaojun Wang,Jingwei Zhang,Dongbo Bu,Shiwei Sun

Research Article

Silicon Prismanes: Calculation and Comparison of Heats of Formation

Journal: Recent Innovations in Chemical Engineering
Volume: 15 Issue: 4 Year: 2022 Page: 247-260
Author(s): Elena A. Zauer,Alexander B. Ershov

Theoretical Studies of the Structure and Properties of Anticancer Drug Taxol

Journal: Current Organic Chemistry
Volume: 16 Issue: 1 Year: 2012 Page: 2321-2331
Author(s): Meiling Zhang, Ce Song, Zhi Yao, Qiang Ji

Theoretical Studies on Pentadienyl Cation Electrocyclizations

Journal: Current Organic Chemistry
Volume: 14 Issue: 1 Year: 2010 Page: 1561-1577
Author(s): Rebecca L. Davis, Dean J. Tantillo

Theoretical Calculations on the Mechanism of the T3P®-Promoted Esterification and Amidation of Phosphinic Acids

Journal: Current Organic Chemistry
Volume: 20 Issue: 10 Year: 2016 Page: 1135-1142
Author(s): Péter Ábrányi-Balogh,Erzsébet Jablonkai,Réka Henyecz,Mátyás Milen,György Keglevich

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