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Application

Discovery Studio 0.6993464052287581 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.059517701385325805 Amorphous Cell 0.29707542329399694 Blends 0.002052334530528476 CASTEP 0.30579784504874297 CDOCKER 0.1267316572601334 CHARMm 0.20574653668547974 COMPASS 0.366341713699333 COMPASS III 0.1267316572601334 COSMObase 0.004617752693689072 COSMOconf 0.007696254489481785 COSMOmic 0.0 COSMOperm 5.13083632632119E-4 COSMOplex 5.13083632632119E-4 COSMOtherm 0.07131862493586455 Catalyst 0.061056952283222166 Classical Simulations 1.0 Conformers 5.13083632632119E-4 Crystallization 0.08055413032324268 DFTB Plus 0.0035915854284248334 DMol3 0.14161108260646485 DPD 0.0015392508978963571 Discover 0.0035915854284248334 Forcite 0.56900974858902 GULP 0.014366341713699333 Kinetix 0.0 LUDI 0.001026167265264238 LibDock 0.05284761416110826 LigandFit 0.002052334530528476 MODELER 0.18214468958440225 Mesocite 0.004617752693689072 Mesoscale 0.005643919958953309 Morphology 0.017957927142124165 ONETEP 0.001026167265264238 Polymorph 0.002052334530528476 QMERA 0.0 Quantum Mechanics 0.4422780913288866 Reflex 0.05900461775269369 Reflex Plus 0.0 Semi-empirical 0.004617752693689072 Sorption 0.06516162134427912 Synthia 0.001026167265264238 TURBOMOLE 0.0 VAMP 0.0 Visualization 0.5484864032837352 X-Cell 0.001026167265264238 ZDOCK 0.021549512570549

Year

2025 0.6752105455876968 2026 1.0 2027 0.0

Keywords

target 1.0 potential 0.28153350892595846 analysis 0.20632133450395082 docking 0.1621305238513316 between 0.14398595258999122 visualization 0.12437810945273632 energy 0.09569798068481124 promising 0.09160081943225051 performance 0.08018729880011706 novel 0.07462686567164178 cell 0.07374890254609306 stability 0.04272753877670471 binding 0.04214223002633889 strategy 0.03804506877377817 strong 0.033362598770851626 enhanced 0.0324846356453029 activity 0.0228270412642669 including 0.021656423763535264 mechanism 0.019022534386889084 effective 0.011706175007316359 experimental 0.01112086625695054 design 0.007609013754755633 development 0.006438396254023998 efficient 0.0038045068773778167 synthesized 0.0
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