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Publications in Theoretical Chemistry
Issue Editorial Masthead
Journal of Physical Chemistry A
Medicine
Theoretical Chemistry
Physical
Fluoroolefins as Peptide Mimetics. 2. A Computational Study of the Conformational Ramifications of Peptide Bond Replacement
Journal of Physical Chemistry A
Medicine
Theoretical Chemistry
Physical
The NRTL-PRA Group Contribution EoS for the Simultaneous Prediction of LLE, VLE and hE of Hydrocarbon Mixtures With Associating Compounds
Fluid Phase Equilibria
Theoretical Chemistry
Astronomy
Physics
Chemical Engineering
Physical
Density Functional Calculation of the Structure and Electronic Properties of CunOn(n= 1−8) Clusters
Journal of Physical Chemistry A
Medicine
Theoretical Chemistry
Physical
The JPC Periodic Table
Journal of Physical Chemistry A
Medicine
Theoretical Chemistry
Physical
Elucidating the 3d Electronic Configuration in Manganese Phthalocyanine
Journal of Physical Chemistry A
Medicine
Theoretical Chemistry
Physical
Calculating Distribution Coefficients Based on Multi-Scale Free Energy Simulations: An Evaluation of MM and QM/MM Explicit Solvent Simulations of Water-Cyclohexane Transfer in the SAMPL5 Challenge
Journal of Computer-Aided Molecular Design
Theoretical Chemistry
Drug Discovery
Computer Science Applications
Physical
Organics Substantially Reduce HO2Uptake Onto Aerosols Containing Transition Metal Ions
Journal of Physical Chemistry A
Medicine
Theoretical Chemistry
Physical
On the Electronic and Structural Properties of Tri-Niobium Oxide Clusters Nb3On−(n= 3−8): Photoelectron Spectroscopy and Density Functional Calculations
Journal of Physical Chemistry A
Medicine
Theoretical Chemistry
Physical
Solid-State NMR Characterization of the Molecular Conformation in Disordered Methyl Α-L-Rhamnofuranoside
Journal of Physical Chemistry A
Medicine
Theoretical Chemistry
Physical
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