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R

Raymond A. Poirier

Memorial University Newfoundland

31H指数
204论文数
3.7K被引数
收录论文 25
发表时间
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Atomic radial correlation energy density components原子径向相关能量密度分量
errComputational and Theoretical Chemistry
IF2.8
err2025-11-14
err0
PREAI
errIbrahim E. Awad; Abd Al-Aziz A. Abu-Saleh; Gurleen Cheema; Joshua W. Hollett; Raymond A. Poirier
err分享
err收藏
ReMLP-NET: A Neural Network Interaction Potential for Molecular Energy Prediction
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2025-10-01
err0
PREAI
errTarkhaneh, Omid; Bungay, Sharene D.; Mawhinney, Robert C.; Poirier, Raymond A.
err分享
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Evaluating the Anticancer Properties of Novel Piscidinol A Derivatives: Insights from DFT, Molecular Docking, and Molecular Dynamics Studies
errACS OMEGA
IF4.3
err2024-11-29
err0
PREAI
errSuha, Humaera Noor; Tasnim, Syed Ahmed; Rahman, Shofiur; Alodhayb, Abdullah; Albrithen, Hamad; Poirier, Raymond A.; Uddin, Kabir M.
err分享
err收藏
Investigating the potential of 6-substituted 3-formyl chromone derivatives as anti-diabetic agents using in silico methods
errSCIENTIFIC REPORTS
IF3.9
err2024-06-08
err2
errOAAI
errSaif, Minhaz Zabin; Esha, Nusrat Jahan Ikbal; Quayum, Syeda Tasnim; Rahman, Shofiur; Al-Gawati, Mahmoud A.; Alsowygh, Ghadah; Albrithen, Hamad; Alodhayb, Abdullah N.; Poirier, Raymond A.; Uddin, Kabir M.
err分享
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Synthesis, spectroscopic characterization, and theoretical studies on the substitution reaction of chromium(III) picolinate
errJOURNAL OF MOLECULAR STRUCTURE
IF4.7
err2019-08-01
err2
PREAI
errUddin, Kabir M.; Alrawashdeh, Ahmad, I; Debnath, Tapas; Aziz, Mohammed Abdul; Poirier, Raymond A.
err分享
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Direct Observation of an Oxepin from a Bacterial Cytochrome P450-Catalyzed Oxidation
errCHEMISTRY-A EUROPEAN JOURNAL
IF3.7
err2016-02-16
err24
errOAAI
errStok, Jeanette E.; Chow, Sharon; Krenske, Elizabeth H.; Soto, Clementina Farfan; Matyas, Csongor; Poirier, Raymond A.; Williams, Craig M.; De Voss, James J.
err分享
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High level ab initio, DFT, and RRKM calculations for the unimolecular decomposition reaction of ethylamine
errnature computational science
IF3.7
err2014-07-01
err22
PREAI
errAlmatarneh, Mansour H.; Altarawneh, Mohammednoor; Poirier, Raymond A.; Saraireh, Ibrahim A.
err分享
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Theoretical Study on the Unimolecular Decomposition of Thiophenol苯硫酚单分子分解的理论研究
errJOURNAL OF COMPUTATIONAL CHEMISTRY
IF4.8
err2011-06-06
err8
PREAI
errAl-Muhtaseb, Ala'a H.; Altarawneh, Mohammednoor; Almatarneh, Mansour H.; Poirier, Raymond A.; Assaf, Niveen W.
err分享
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SEST: Simulated Electronic Structure Theory
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2008-12-12
err1
PREAI
errHollett, Joshua W.; Poirier, Raymond A.
err分享
err收藏
Mechanisms for the deamination reaction of cytosine with H2O/OH- and 2H2O/OH-:: A computational study
errJOURNAL OF CHEMICAL INFORMATION AND MODELING
IF5.3
err2008-04-02
err44
PREAI
errAlmatarneh, Mansour H.; Flinn, Christopher G.; Poirier, Raymond A.
err分享
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Comparison of the standard 6-31G and binning-curtiss basis sets for third row elements
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2007-11-08
err23
PREAI
errIslam, Shahidul M.; Huelin, Stephanie D.; Dawe, Margot; Poirier, Raymond A.
err分享
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An evaluation of the radial part of numerical integration commonly used in DFT
errJOURNAL OF COMPUTATIONAL CHEMISTRY
IF4.8
err2004-06-01
err21
PREAI
errEl-Sherbiny, A; Poirier, RA
err分享
err收藏
A THEORETICAL-STUDY OF THE RELATIONSHIP BETWEEN SECONDARY ALPHA-DEUTERIUM KINETIC ISOTOPE EFFECTS AND THE STRUCTURE OF S(N)2 TRANSITION-STATES
errJOURNAL OF THE AMERICAN CHEMICAL SOCIETY
IF15.6
err2002-05-01
err136
PREAI
errPOIRIER, RA; WANG, YL; WESTAWAY, KC
err分享
err收藏
BONDING BETWEEN NONBONDED SULFUR AND OXYGEN-ATOMS IN SELECTED ORGANIC-MOLECULES (A QUANTUM CHEMICAL STUDY)
errJOURNAL OF THE AMERICAN CHEMICAL SOCIETY
IF15.6
err2002-05-01
err150
PREAI
errANGYAN, JG; POIRIER, RA; KUCSMAN, A; CSIZMADIA, IG
err分享
err收藏
ENZYMATIC CARBOXYL TRANSFER FROM N-CARBOXYBIOTIN - A MOLECULAR-ORBITAL EVALUATION OF CONFORMATIONAL EFFECTS IN PROMOTING REACTIVITY
errJOURNAL OF THE AMERICAN CHEMICAL SOCIETY
IF15.6
err2002-05-01
err27
PREAI
errTHATCHER, GRJ; POIRIER, R; KLUGER, R
err分享
err收藏
Endo-exo and facial stereoselectivity in the Diels-Alder reactions of 3-substituted cyclopropenes with butadiene
errJOURNAL OF THE AMERICAN CHEMICAL SOCIETY
IF15.6
err2001-05-16
err34
PREAI
errXidos, JD; Gosse, TL; Burke, ED; Poirier, RA; Burnell, DJ
err分享
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Nonplanar aromatic compounds.: 5.: A strategy for the synthesis of cis-10b,10c-dimethyl-10b,10c-dihydropyrenes.: First crystal structure of a cis-10b,10c-dimethyl-10b,10c-dihydropyrene
errJOURNAL OF THE AMERICAN CHEMICAL SOCIETY
IF15.6
err2001-04-27
err24
PREAI
errBodwell, GJ; Bridson, JN; Chen, SL; Poirier, RA
err分享
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Theoretical analysis of effects of π-conjugating substituents on building blocks for conducting polymers
errJOURNAL OF ORGANIC CHEMISTRY
IF3.6
err1999-09-16
err20
PREAI
errSalzner, U; Lagowski, JB; Pickup, PG; Poirier, RA
err分享
err收藏
Comparison of geometries and electronic structures of polyacetylene, polyborole, polycyclopentadiene, polypyrrole, polyfuran, polysilole, polyphosphole, polythiophene, polyselenophene and polytellurophene
errSYNTHETIC METALS
IF4.6
err1998-08-01
err357
PREAI
errSalzner, U; Lagowski, JB; Pickup, PG; Poirier, RA
err分享
err收藏
Graphical approach for defining natural internal coordinates
errJOURNAL OF COMPUTATIONAL CHEMISTRY
IF4.8
err1998-04-15
err8
PREAI
errPye, CC; Poirier, RA
err分享
err收藏

研究方向

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合作学者
合作期刊
A
Ala’a H. Al‐Muhtaseb
H 指数: 77 · 论文数: 281
P
Peter G. Pickup
H 指数: 56 · 论文数: 239
J
János G. Ángyán
H 指数: 47 · 论文数: 169
I
Imre G. Csizmadia
H 指数: 45 · 论文数: 521
J
James J. De Voss
H 指数: 45 · 论文数: 365
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