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Application

Discovery Studio 1.0 Materials Studio 0.9919323857087975 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.051560379918588875 Amorphous Cell 0.2736318407960199 Blends 0.0018091361374943465 CASTEP 0.2876526458616011 CDOCKER 0.17096336499321574 CHARMm 0.2700135685210312 COMPASS 0.33966530981456355 COMPASS III 0.114880144730891 COSMObase 0.004522840343735866 COSMOconf 0.007688828584350972 COSMOmic 0.0 COSMOperm 4.522840343735866E-4 COSMOplex 4.522840343735866E-4 COSMOquick 4.522840343735866E-4 COSMOtherm 0.06241519674355495 Catalyst 0.0741745816372682 Classical Simulations 1.0 Conformers 4.522840343735866E-4 Crystallization 0.07507914970601538 DFTB Plus 0.003165988240615106 DMol3 0.13387607417458164 DPD 0.0013568521031207597 Discover 0.004522840343735866 Forcite 0.5246494798733605 GULP 0.013568521031207599 Kinetix 0.0 LUDI 0.003165988240615106 LibDock 0.07191316146540028 LigandFit 0.003618272274988693 MODELER 0.2573496155585708 Mesocite 0.003618272274988693 Mesoscale 0.004522840343735866 Morphology 0.017186793306196293 ONETEP 9.045680687471732E-4 Polymorph 0.003618272274988693 QMERA 0.0 QSAR 0.0 Quantum Mechanics 0.4156490275893261 Reflex 0.052917232021709636 Reflex Plus 4.522840343735866E-4 Semi-empirical 0.003618272274988693 Sorption 0.06467661691542288 Synthia 9.045680687471732E-4 TURBOMOLE 0.0 Visualization 0.66078697421981 X-Cell 0.0013568521031207597 ZDOCK 0.028946178199909543

Year

2024 0.061606160616061605 2025 0.9875320865419875 2026 1.0 2027 0.0

Keywords

target 1.0 potential 0.31996179560649474 docking 0.22731614135625597 analysis 0.22349570200573066 visualization 0.15329512893982808 between 0.12893982808022922 promising 0.09622731614135625 novel 0.08858643744030563 binding 0.07473734479465138 energy 0.06638013371537727 cell 0.05873925501432665 activity 0.04608404966571156 stability 0.03844317096466093 performance 0.03247373447946514 including 0.031757402101241644 strong 0.03151862464183381 effective 0.014326647564469915 development 0.011461318051575931 strategy 0.010267430754536771 therapeutic 0.009789875835721109 enhanced 0.008357211079274117 synthesized 0.0052531041069723014 mechanism 0.0031041069723018147 design 4.775549188156638E-4 experimental 0.0
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