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Application

Discovery Studio 1.0 Materials Studio 0.6348228043143297 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.04152249134948097 Amorphous Cell 0.24452133794694347 Blends 0.0011534025374855825 CASTEP 0.18800461361014995 CDOCKER 0.21683967704728951 CHARMm 0.32987312572087657 COMPASS 0.3033448673587082 COMPASS III 0.10841983852364476 COSMObase 0.002306805074971165 COSMOconf 0.00922722029988466 COSMOmic 0.0 COSMOperm 0.0 COSMOtherm 0.06459054209919261 Catalyst 0.09342560553633218 Classical Simulations 1.0 Crystallization 0.0657439446366782 DFTB Plus 0.0011534025374855825 DMol3 0.07958477508650519 DPD 0.002306805074971165 Discover 0.0034602076124567475 Forcite 0.47750865051903113 GULP 0.006920415224913495 Kinetix 0.0 LUDI 0.0 LibDock 0.0853517877739331 LigandFit 0.0011534025374855825 MODELER 0.30680507497116494 Mesocite 0.002306805074971165 Mesoscale 0.00461361014994233 Morphology 0.01384083044982699 ONETEP 0.002306805074971165 Polymorph 0.0 Quantum Mechanics 0.2675893886966551 Reflex 0.04728950403690888 Semi-empirical 0.0011534025374855825 Sorption 0.05536332179930796 Synthia 0.0 TURBOMOLE 0.0 Visualization 0.8281430219146482 ZDOCK 0.03229527104959631

Year

2025 1.0 2026 0.687221396731055 2027 0.0

Keywords

target 1.0 potential 0.33657482441923287 docking 0.2938951917882226 analysis 0.23392760669908158 visualization 0.20421393841166938 binding 0.11831442463533225 novel 0.10210696920583469 between 0.097784981091302 promising 0.097784981091302 activity 0.08157752566180443 therapeutic 0.05780659103187466 cell 0.04321988114532685 stability 0.03241491085899514 strong 0.030253916801728797 including 0.027552674230145867 synthesized 0.018368449486763912 mechanism 0.01620745542949757 protein 0.014586709886547812 development 0.01350621285791464 effective 0.009184224743381956 energy 0.007563479200432199 strategy 0.0021609940572663426 synthesis 0.0021609940572663426 inhibition 5.402485143165856E-4 interaction 0.0
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