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Application

Discovery Studio 0.9513162639740353 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06548672566371681 Amorphous Cell 0.29513274336283185 Blends 0.002654867256637168 CASTEP 0.3398230088495575 CDOCKER 0.1588495575221239 CHARMm 0.26415929203539823 COMPASS 0.3415929203539823 COMPASS III 0.10486725663716814 COSMObase 0.0048672566371681415 COSMOconf 0.006194690265486726 COSMOperm 4.424778761061947E-4 COSMOquick 0.001327433628318584 COSMOtherm 0.06548672566371681 Catalyst 0.07256637168141593 Classical Simulations 1.0 Conformers 0.0 Crystallization 0.06858407079646017 DFTB Plus 4.424778761061947E-4 DMol3 0.1504424778761062 DPD 0.0017699115044247787 Discover 0.006194690265486726 Forcite 0.5305309734513274 GULP 0.017699115044247787 LUDI 0.004424778761061947 LibDock 0.06725663716814159 LigandFit 0.003982300884955752 MCSS 4.424778761061947E-4 MODELER 0.24380530973451328 MesoDyn 8.849557522123894E-4 Mesocite 0.003097345132743363 Mesoscale 0.005752212389380531 Morphology 0.015486725663716814 ONETEP 0.0 Polymorph 0.001327433628318584 QMERA 0.0 QSAR 8.849557522123894E-4 Quantum Mechanics 0.479646017699115 Reflex 0.05088495575221239 Reflex Plus 0.0 Semi-empirical 0.002654867256637168 Sorption 0.05176991150442478 Synthia 4.424778761061947E-4 TURBOMOLE 0.0 VAMP 0.001327433628318584 Visualization 0.6747787610619469 X-Cell 0.001327433628318584 ZDOCK 0.029646017699115044

Year

2024 0.3593694016481548 2025 1.0 2026 0.745969186671444 2027 0.0

Keywords

target 1.0 potential 0.3045080190723884 docking 0.21976592977893367 analysis 0.21651495448634592 visualization 0.15951452102297356 between 0.15257910706545297 novel 0.09861291720849588 promising 0.09276116168183789 energy 0.08170784568703944 binding 0.0812743823146944 cell 0.07152145643693109 activity 0.05028175119202427 stability 0.047247507585609014 performance 0.045513654096228866 including 0.02860858257477243 strong 0.02860858257477243 enhanced 0.022540095361941917 experimental 0.021673168617251843 development 0.021239705244906804 effective 0.019722583441699176 mechanism 0.01928912006935414 synthesized 0.014737754659731253 design 0.011053315994798439 interaction 0.010836584308625921 strategy 0.0
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