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Application

Discovery Studio 0.840223232740802 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06188503366131538 Amorphous Cell 0.28819264629725533 Blends 0.002330398757120663 CASTEP 0.331693423096841 CDOCKER 0.15018125323666495 CHARMm 0.2439150699119627 COMPASS 0.35344381149663384 COMPASS III 0.10952874158467116 COSMObase 0.0054375970999482135 COSMOconf 0.006214396685655101 COSMOmic 0.0 COSMOperm 5.178663904712584E-4 COSMOplex 2.589331952356292E-4 COSMOquick 0.0010357327809425167 COSMOtherm 0.06706369756602797 Catalyst 0.0647332988089073 Classical Simulations 1.0 Conformers 2.589331952356292E-4 Crystallization 0.07483169342309684 DFTB Plus 0.0036250647332988087 DMol3 0.1576903158984982 DPD 0.002589331952356292 Discover 0.004919730709476955 Forcite 0.5409114448472294 GULP 0.018125323666494046 Kinetix 0.0 LUDI 0.0033661315380631796 LibDock 0.06188503366131538 LigandFit 0.0031071983428275505 MODELER 0.22760227861211807 MesoDyn 5.178663904712584E-4 Mesocite 0.0031071983428275505 Mesoscale 0.005955463490419472 Modules 0.0 Morphology 0.016571724495080268 ONETEP 7.767995857068876E-4 Polymorph 0.002330398757120663 QMERA 2.589331952356292E-4 QSAR 5.178663904712584E-4 Quantum Mechanics 0.48006214396685654 Reflex 0.05463490419471776 Reflex Plus 7.767995857068876E-4 Semi-empirical 0.004919730709476955 Sorption 0.05748316934230968 Synthia 7.767995857068876E-4 TURBOMOLE 0.0 VAMP 5.178663904712584E-4 Visualization 0.6198860693940963 X-Cell 0.001294665976178146 ZDOCK 0.025375453133091662

Year

2024 0.16985049833887042 2025 1.0 2026 0.8409468438538206 2027 0.0

Keywords

target 1.0 potential 0.2975016880486158 analysis 0.21269412559081702 docking 0.19257258609047942 between 0.14908845374746793 visualization 0.1400405131667792 energy 0.0887238352464551 promising 0.087643484132343 novel 0.08426738690074274 cell 0.06671168129642134 binding 0.06293045239702903 performance 0.053342336259284265 stability 0.042538825118163405 activity 0.031330182309250505 strong 0.02187711006076975 including 0.02174206617150574 enhanced 0.01823092505064146 effective 0.015935178933153275 development 0.01161377447670493 experimental 0.009318028359216746 synthesized 0.007832545577312626 mechanism 0.007697501688048616 strategy 0.007427413909520594 design 0.001485482781904119 interaction 0.0
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