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Application

Discovery Studio 1.0 Materials Studio 0.8222506393861893 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05188067444876784 Amorphous Cell 0.2619974059662776 Blends 8.646779074794639E-4 CASTEP 0.27150886294855164 CDOCKER 0.19368785127539992 CHARMm 0.3052313013402508 COMPASS 0.3216601815823606 COMPASS III 0.11240812797233031 COSMObase 0.0038910505836575876 COSMOconf 0.006917423259835711 COSMOmic 0.0 COSMOperm 4.3233895373973193E-4 COSMOplex 4.3233895373973193E-4 COSMOquick 4.3233895373973193E-4 COSMOtherm 0.058798097708603544 Catalyst 0.08041504539559015 Classical Simulations 1.0 Conformers 4.3233895373973193E-4 Crystallization 0.07263294422827497 DFTB Plus 0.0030263726761781237 DMol3 0.12624297449200172 DPD 0.0012970168612191958 Discover 0.0034587116299178555 Forcite 0.4963251188932123 GULP 0.011673151750972763 Kinetix 0.0 LUDI 0.0030263726761781237 LibDock 0.07782101167315175 LigandFit 0.0038910505836575876 MODELER 0.28491137051448334 Mesocite 0.0034587116299178555 Mesoscale 0.00432338953739732 Morphology 0.016861219195849545 ONETEP 8.646779074794639E-4 Polymorph 0.0017293558149589277 QMERA 0.0 Quantum Mechanics 0.3925637699956766 Reflex 0.0527453523562473 Reflex Plus 0.0 Semi-empirical 0.00432338953739732 Sorption 0.06009511456982274 Synthia 8.646779074794639E-4 TURBOMOLE 0.0 VAMP 4.3233895373973193E-4 Visualization 0.7527021184608733 X-Cell 4.3233895373973193E-4 ZDOCK 0.0324254215304799

Year

2024 0.05832518735744542 2025 1.0 2026 0.9292929292929293 2027 0.0

Keywords

target 1.0 potential 0.3394097222222222 docking 0.2599826388888889 analysis 0.2328559027777778 visualization 0.1857638888888889 between 0.12348090277777778 binding 0.09526909722222222 promising 0.09440104166666667 novel 0.091796875 activity 0.05967881944444445 energy 0.05360243055555555 cell 0.050130208333333336 stability 0.03927951388888889 strong 0.030598958333333332 including 0.028862847222222224 performance 0.018880208333333332 development 0.013671875 therapeutic 0.012803819444444444 effective 0.011284722222222222 mechanism 0.009114583333333334 synthesized 0.007378472222222222 protein 0.005425347222222222 strategy 0.0013020833333333333 interaction 6.510416666666666E-4 enhanced 0.0
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