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Application

Discovery Studio 0.19909017928819908 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.07288765088207985 Amorphous Cell 0.38207985143918294 Blends 4.6425255338904364E-4 CASTEP 0.5687093779015785 CDOCKER 0.03667595171773445 CHARMm 0.08867223769730734 COMPASS 0.43129062209842156 COMPASS III 0.13881151346332404 COSMObase 0.0032497678737233053 COSMOconf 0.003714020427112349 COSMOperm 4.6425255338904364E-4 COSMOplex 0.0 COSMOquick 0.0 COSMOtherm 0.055710306406685235 Catalyst 0.027390900649953576 Classical Simulations 1.0 Conformers 4.6425255338904364E-4 Crystallization 0.07799442896935933 DFTB Plus 0.006963788300835654 DMol3 0.25069637883008355 DPD 0.0018570102135561746 Discover 0.005571030640668524 Forcite 0.658774373259053 GULP 0.031104921077065924 LUDI 0.001392757660167131 LibDock 0.009285051067780872 LigandFit 4.6425255338904364E-4 MODELER 0.050603528319405754 MesoDyn 0.0 Mesocite 0.002321262766945218 Mesoscale 0.004642525533890436 Morphology 0.02042711234911792 ONETEP 0.001392757660167131 Polymorph 0.004178272980501393 QMERA 0.0 QSAR 0.0 Quantum Mechanics 0.8008356545961003 Reflex 0.052924791086350974 Semi-empirical 0.007428040854224698 Sorption 0.07845868152274837 Synthia 0.0018570102135561746 TURBOMOLE 0.0 Visualization 0.3277623026926648 X-Cell 9.285051067780873E-4 ZDOCK 0.007428040854224698

Year

2023 0.09364548494983277 2024 0.20252694165737645 2025 1.0 2026 0.5039018952062431 2027 0.0

Keywords

energy 1.0 target 0.9031017071411397 potential 0.1995672036547247 between 0.19067083433517673 analysis 0.15195960567444097 performance 0.14402500601106036 stability 0.09449386871844194 cell 0.0839144025006011 experimental 0.06395768213512863 promising 0.0553017552296225 efficient 0.048809810050492904 interaction 0.044241404183698006 amorphous 0.03750901659052657 enhanced 0.03438326520798269 stable 0.03270016830968983 higher 0.019235393123346958 adsorption 0.01899495070930512 novel 0.01899495070930512 temperature 0.010098581389757152 surface 0.008655926905506131 effective 0.00793459966338062 visualization 0.004808848280836739 including 0.0045684058667949026 design 0.0031257513825438807 strategy 0.0
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