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Application

Discovery Studio 1.0 Materials Studio 0.37294332723948814 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.04595879556259905 Amorphous Cell 0.08082408874801902 Blends 0.001584786053882726 CASTEP 0.1664025356576862 CDOCKER 0.16957210776545167 CHARMm 0.27258320126782887 COMPASS 0.14421553090332806 COMPASS III 0.02694136291600634 COSMOquick 0.0 COSMOtherm 0.014263074484944533 Catalyst 0.294770206022187 Classical Simulations 0.6148969889064976 Crystallization 0.06339144215530904 DFTB Plus 0.004754358161648178 DMol3 0.11410459587955626 Forcite 0.23613312202852615 GULP 0.011093502377179081 LUDI 0.001584786053882726 LibDock 0.061806656101426306 LigandFit 0.0 MODELER 0.196513470681458 Mesocite 0.0 Mesoscale 0.0 Morphology 0.009508716323296355 QSAR 0.0 Quantum Mechanics 0.277337559429477 Reflex 0.05071315372424723 Reflex Plus 0.0 Semi-empirical 0.004754358161648178 Sorption 0.025356576862123614 Visualization 1.0 ZDOCK 0.006339144215530904

Year

2023 0.29701492537313434 2024 0.764179104477612 2025 1.0 2026 0.22388059701492538 2027 0.0

Keywords

synthesis 1.0 target 0.9654377880184332 docking 0.42242703533026116 synthesized 0.4185867895545315 potential 0.3317972350230415 visualization 0.3064516129032258 novel 0.27342549923195086 compound 0.18740399385560677 activity 0.1781874039938556 design 0.16129032258064516 analysis 0.1597542242703533 promising 0.14285714285714285 binding 0.10752688172043011 vitro 0.0944700460829493 potent 0.0837173579109063 inhibition 0.0629800307219662 silico 0.0576036866359447 between 0.053763440860215055 evaluation 0.02457757296466974 development 0.023809523809523808 drug 0.02227342549923195 characterization 0.018433179723502304 active 0.0038402457757296467 cell 0.0038402457757296467 designed 0.0
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