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Application

Discovery Studio 0.7453051643192489 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.10819165378670788 Amorphous Cell 0.25193199381761977 Blends 0.0061823802163833074 CASTEP 0.42040185471406494 CDOCKER 0.1143740340030912 CHARMm 0.21483771251931993 COMPASS 0.3941267387944359 COMPASS III 0.07727975270479134 COSMObase 0.00927357032457496 COSMOconf 0.0077279752704791345 COSMOmic 0.0 COSMOperm 0.0030911901081916537 COSMOquick 0.0030911901081916537 COSMOtherm 0.15146831530139104 Catalyst 0.14528593508500773 Classical Simulations 1.0 Conformers 0.0015455950540958269 Crystallization 0.08191653786707882 DFTB Plus 0.010819165378670788 DMol3 0.23493044822256567 DPD 0.0015455950540958269 Discover 0.00463678516228748 Forcite 0.5394126738794436 GULP 0.02627511591962906 Kinetix 0.0 LUDI 0.00927357032457496 LibDock 0.06027820710973725 LigandFit 0.0030911901081916537 MCSS 0.0 MODELER 0.14528593508500773 Mesocite 0.0 Mesoscale 0.0030911901081916537 Morphology 0.013910355486862442 ONETEP 0.0 Polymorph 0.0015455950540958269 QMERA 0.0 QSAR 0.0 Quantum Mechanics 0.6460587326120556 Reflex 0.0633693972179289 Semi-empirical 0.01854714064914992 Sorption 0.04482225656877898 Synthia 0.0 TURBOMOLE 0.0 VAMP 0.00463678516228748 Visualization 0.6676970633693973 ZDOCK 0.00927357032457496

Year

2022 0.0 2023 0.3203753351206434 2024 0.6715817694369973 2025 1.0 2026 0.403485254691689

Keywords

chemical 1.0 target 0.9474025974025974 potential 0.2571428571428571 docking 0.18636363636363637 analysis 0.18506493506493507 between 0.16233766233766234 visualization 0.12402597402597403 experimental 0.10454545454545454 energy 0.09415584415584416 novel 0.07532467532467532 including 0.05714285714285714 binding 0.03896103896103896 promising 0.03506493506493506 stability 0.03506493506493506 activity 0.031818181818181815 performance 0.02792207792207792 effective 0.023376623376623377 cell 0.022727272727272728 development 0.02207792207792208 synthesized 0.02142857142857143 synthesis 0.014935064935064935 interaction 0.00909090909090909 adsorption 0.005844155844155844 well 0.001948051948051948 design 0.0
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