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Application

Discovery Studio 0.8113074204946996 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06259226454089165 Amorphous Cell 0.29465603779155597 Blends 0.002066725715972837 CASTEP 0.32860938883968116 CDOCKER 0.14732801889577798 CHARMm 0.23472099202834368 COMPASS 0.34986713906111605 COMPASS III 0.11455565397106585 COSMObase 0.0047239444936522 COSMOconf 0.006790670209625037 COSMOmic 0.0 COSMOperm 5.90493061706525E-4 COSMOplex 2.952465308532625E-4 COSMOquick 2.952465308532625E-4 COSMOtherm 0.07056392087392974 Catalyst 0.0684971951579569 Classical Simulations 1.0 Conformers 5.90493061706525E-4 Crystallization 0.07764983761440802 DFTB Plus 0.002952465308532625 DMol3 0.15234720992028344 DPD 0.0023619722468261 Discover 0.003838204901092412 Forcite 0.551225273103041 GULP 0.015943312666076175 Kinetix 2.952465308532625E-4 LUDI 0.002952465308532625 LibDock 0.05757307351638618 LigandFit 0.002952465308532625 MODELER 0.21700620017714792 MesoDyn 0.0 Mesocite 0.003247711839385887 Mesoscale 0.005609684086211987 Morphology 0.01801003838204901 ONETEP 0.00118098612341305 Polymorph 0.0014762326542663124 QMERA 2.952465308532625E-4 QSAR 2.952465308532625E-4 Quantum Mechanics 0.47298494242692646 Reflex 0.056392087392973134 Reflex Plus 2.952465308532625E-4 Semi-empirical 0.005019191024505462 Sorption 0.059935045763212284 Synthia 0.00118098612341305 TURBOMOLE 0.0 VAMP 0.00118098612341305 Visualization 0.6055506347800413 X-Cell 0.002066725715972837 ZDOCK 0.02421021552996752

Year

2024 0.13277428371767994 2025 1.0 2026 0.8248311204286047 2027 0.0

Keywords

target 1.0 potential 0.2908366533864542 analysis 0.20962304627643272 docking 0.1855654305853509 between 0.1463377260190009 visualization 0.13806313208703647 energy 0.09148023291449586 promising 0.08535090407600368 novel 0.08060067422617223 cell 0.07048728164266013 performance 0.06527735212994178 binding 0.055776892430278883 stability 0.046582899172540604 activity 0.032178976402083975 enhanced 0.02482378179589335 experimental 0.02252528348145878 including 0.02221881703953417 strong 0.021605884155684953 mechanism 0.0165491878639289 strategy 0.015476555317192768 effective 0.013484523444682808 development 0.011645724793135151 synthesized 0.011492491572172848 design 0.0056696291756052715 interaction 0.0
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