Serendipitous isolation of a disappearing conformational polymorph of succinic acid challenges computational polymorph prediction

Serendipitous isolation of a disappearing conformational polymorph of succinic acid challenges computational polymorph prediction is …
instance of (P31):
scholarly articleQ13442814

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P356DOI10.1039/C8CE00625C

P50authorLouise S. PriceQ60978917
Rui GuoQ61050473
Paolo LucaioliQ61050474
Sarah L. PriceQ30010648
Ishwar SinghQ49064976
Matteo SalvalaglioQ57617990
P2093author name stringLuca Iuzzolino
Elisa Nauha
Nicholas Blagden
Ilaria Gimondi
P2860cites workMarkov state models of biomolecular conformational dynamicsQ26827934
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Serendipity and four polymorphic structures of benzidine, C12H12N2Q80248554
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The conformation of succinic acid in aqueous solution studied by 1h and 13c nmrQ126382420
Investigating the latent polymorphism of maleic acidQ28286724
Development and testing of a general amber force fieldQ29547642
Canonical sampling through velocity rescalingQ29616131
Fascination with the conformational analysis of succinic acid, as evaluated by NMR spectroscopy, and why.Q31086159
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Crystal engineering of active pharmaceutical ingredients to improve solubility and dissolution ratesQ36863314
Disappearing polymorphs revisitedQ38510810
Solvation and surface effects on polymorph stabilities at the nanoscaleQ38752327
Accurate and efficient representation of intramolecular energy in ab initio generation of crystal structures. I. Adaptive local approximate models.Q42359623
Markov models of molecular kinetics: Generation and validationQ43633887
Crystal engineering of the composition of pharmaceutical phases.Q44314122
Selective polymorph transformation via solvent-drop grindingQ45256771
New polymorphs of isonicotinamide and nicotinamideQ46322581
Efficient Handling of Molecular Flexibility in Lattice Energy Minimization of Organic CrystalsQ51559441
The polymorphism of progesterone: stabilization of a 'disappearing' polymorph by co-crystallizationQ51910743
Tuning Crystal Morphology of Succinic Acid Using a Polymer AdditiveQ54888115
Studien über die Bildung und Umwandlung fester KörperQ56038812
The effect of crystal morphology and mill type on milling induced crystal disorderQ57259174
Molecular dynamics with coupling to an external bathQ57569060
First principles methods using CASTEPQ58818470
Highly Unusual Triangular Crystals of Theophylline: The Influence of Solvent on the Growth Rates of Polar Crystal FacesQ59581065
The curious case of (caffeine)·(benzoic acid): how heteronuclear seeding allowed the formation of an elusive cocrystalQ59581080
Modelling organic crystal structures using distributed multipole and polarizability-based model intermolecular potentialsQ59581133
Isomorphous template induced crystallisation: a robust method for the targeted crystallisation of computationally predicted metastable polymorphsQ60488235
Why don't we find more polymorphs?Q60488250
Screening for cocrystals of succinic acid and 4-aminobenzoic acidQ60488253
P433issue28
P921main subjectcondensed matter physicsQ214781
Crystal structure predictionQ5191417
P304page(s)3971-3977
P577publication date2018-01-01
P1433published inCrystEngCommQ3005984
P1476titleSerendipitous isolation of a disappearing conformational polymorph of succinic acid challenges computational polymorph prediction
P478volume20

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cites work (P2860)
Q92504018A Prolific Solvate Former, Galunisertib, under the Pressure of Crystal Structure Prediction, Produces Ten Diverse Polymorphs
Q111149814A complete description of thermodynamic stabilities of molecular crystals
Q128727138A new polymorph of the common coformer isonicotinamide
Q57784201Is zeroth order crystal structure prediction (CSP_0) coming to maturity? What should we aim for in an ideal crystal structure prediction code?
Q128144922Solid Forms of Ciprofloxacin Salicylate: Polymorphism, Formation Pathways, and Thermodynamic Stability
Q113315080Toward Physics-Based Solubility Computation for Pharmaceuticals to Rival Informatics

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