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Application

Discovery Studio 0.9787798408488063 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06092045756850226 Amorphous Cell 0.2774674115456238 Blends 0.0023942537909018356 CASTEP 0.3133812184091514 CDOCKER 0.16626762436818301 CHARMm 0.26975259377494015 COMPASS 0.33812184091513703 COMPASS III 0.10534716679968077 COSMObase 0.005320563979781857 COSMOconf 0.005852620377760042 COSMOmic 0.0 COSMOperm 5.320563979781857E-4 COSMOplex 2.6602819898909286E-4 COSMOquick 0.0010641127959563714 COSMOtherm 0.06464485235434957 Catalyst 0.07528598031391327 Classical Simulations 1.0 Conformers 5.320563979781857E-4 Crystallization 0.07342378292098962 DFTB Plus 0.003458366586858207 DMol3 0.1516360734237829 DPD 0.0026602819898909284 Discover 0.005054535780792764 Forcite 0.524341580207502 GULP 0.017025804735301943 Kinetix 0.0 LUDI 0.0039904229848363925 LibDock 0.06783719074221868 LigandFit 0.0031923383878691143 MODELER 0.2527267890396382 MesoDyn 5.320563979781857E-4 Mesocite 0.0031923383878691143 Mesoscale 0.006118648576749135 Morphology 0.016493748337323755 ONETEP 7.980845969672786E-4 Polymorph 0.0023942537909018356 QMERA 2.6602819898909286E-4 QSAR 5.320563979781857E-4 Quantum Mechanics 0.4565043894652833 Reflex 0.053471667996807665 Reflex Plus 5.320563979781857E-4 Semi-empirical 0.005054535780792764 Sorption 0.055865921787709494 Synthia 7.980845969672786E-4 TURBOMOLE 0.0 VAMP 7.980845969672786E-4 Visualization 0.6749135408353285 X-Cell 0.0013301409949454642 ZDOCK 0.027666932694865656

Year

2024 0.24391847468770544 2025 1.0 2026 0.8783694937541091 2027 0.0

Keywords

target 1.0 potential 0.3108948364422817 analysis 0.22452014057853473 docking 0.22289808056231414 visualization 0.15869153825358204 between 0.14503919978372534 promising 0.09191673425250067 novel 0.0893484725601514 binding 0.07583130575831305 energy 0.07272235739389024 cell 0.06312516896458502 activity 0.04352527710191944 stability 0.04271424709380914 performance 0.039875642065423086 including 0.022303325223033254 strong 0.0202757502027575 effective 0.016896458502297918 enhanced 0.01338199513381995 development 0.012435793457691267 synthesized 0.010543390105433901 mechanism 0.007975128413084618 experimental 0.0056772100567721 strategy 0.0022979183563125167 interaction 0.0012165450121654502 design 0.0
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